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

Systemtic Name: 3-azanyl-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: 3-amino-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: 3-amino-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: 3-amino-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: 3-amino-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C10H11N5OS MolecularWeight: 249.29224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)N)CSC2=NC=NN2

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)N)CSC2=NC=NN2

InChI

InChI=1S/C10H11N5OS/c11-8-3-6(9(12)16)1-2-7(8)4-17-10-13-5-14-15-10/h1-3,5H,4,11H2,(H2,12,16)(H,13,14,15)