Compound Identification
SMILES
NC(=N)SCCC#N.CC1=CC=C(C=C1)S(O)(=O)=O
InChIKey
InChIKey=YPIIOSFGVPJSFB-UHFFFAOYSA-N
Formula
C11H15N3O3S2
Mass
301.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
- Class Isothioureas
-
Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Isothioureas
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isothioureas
Alternative Parents
Sulfenyl compounds Nitriles Carboximidamides Organopnictogen compounds Imines Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Isothiourea - Sulfenyl compound - Carboximidamide - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Imine - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as isothioureas. These are organic compounds containing the isothiourea group, with the general structure R1SC(=NR2)N(R3)R4 (R1,R2,R3,R4=H, alkyl, aryl).
External Descriptors
Not available