3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzenecarbothioamide

Systemtic Name: 3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzenecarbothioamide Openeye Name: 3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzenecarbothioamide CAS Name: 3-[(1H-1,2,4-triazol-5-ylthio)methyl]benzenecarbothioamide IUPAC Name: 3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzenecarbothioamide Traditional Name: 3-[(1H-1,2,4-triazol-5-ylthio)methyl]thiobenzamide Formula: C10H10N4S2 MolecularWeight: 250.3432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=NC=NN2)C(=S)N

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=NC=NN2)C(=S)N

InChI

InChI=1S/C10H10N4S2/c11-9(15)8-3-1-2-7(4-8)5-16-10-12-6-13-14-10/h1-4,6H,5H2,(H2,11,15)(H,12,13,14)