N-[4-[(4-azanyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: N-[4-[(4-azanyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-1,3-thiazol-2-yl]benzamide Openeye Name: N-[4-[(4-amino-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]thiazol-2-yl]benzamide CAS Name: N-[4-[(4-amino-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-2-thiazolyl]benzamide IUPAC Name: N-[4-[(4-amino-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-1,3-thiazol-2-yl]benzamide Traditional Name: N-[4-[(4-amino-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]thiazol-2-yl]benzamide Formula: C13H12N6OS2 MolecularWeight: 332.40398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=NC(=CS2)CC3=NNC(=S)N3N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=NC(=CS2)CC3=NNC(=S)N3N

InChI

InChI=1S/C13H12N6OS2/c14-19-10(17-18-13(19)21)6-9-7-22-12(15-9)16-11(20)8-4-2-1-3-5-8/h1-5,7H,6,14H2,(H,18,21)(H,15,16,20)