Structure Information
Structure

Compound Identification

SMILES

CC1=NN(C2=NC(N)=NC(=N2)C(=C\C2=CC=C(S2)[N+]([O-])=O)\C#N)C(C)(C)C1

InChIKey

InChIKey=RWVZBXAFTQJQIA-UXBLZVDNSA-N

Formula

C16H16N8O2S

Mass

384.42

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thiophenes

Subclass

Nitrothiophenes

Intermediate Tree Nodes

Not available

Direct Parent

2-nitrothiophenes

Alternative Parents

Nitroaromatic compounds 2,5-disubstituted thiophenes Aminotriazines 1,3,5-triazines Pyrazolines Heteroaromatic compounds N-alkylated hydrazones Nitriles Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives Primary amines Organic zwitterions

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-nitrothiophene - Nitroaromatic compound - Amino-1,3,5-triazine - Aminotriazine - 2,5-disubstituted thiophene - Triazine - 1,3,5-triazine - Pyrazoline - Heteroaromatic compound - C-nitro compound - N-alkylated hydrazone - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic 1,3-dipolar compound - Hydrazone - Carbonitrile - Nitrile - Organic oxoazanium - Organic oxygen compound - Organonitrogen compound - Primary amine - Amine - Organopnictogen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 2-nitrothiophenes. These are aromatic heterocyclic compound containing a nitro group attached to a thiophene ring a the 2-position.

External Descriptors

Not available

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