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

Systemtic Name: N-[3-(phenylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzamide Openeye Name: N-(3-benzyl-5-thioxo-1H-1,2,4-triazol-4-yl)benzamide CAS Name: N-[3-(phenylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzamide IUPAC Name: N-(3-benzyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzamide Traditional Name: N-(3-benzyl-5-thioxo-1H-1,2,4-triazol-4-yl)benzamide Formula: C16H14N4OS MolecularWeight: 310.37356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NNC(=S)N2NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC2=NNC(=S)N2NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H14N4OS/c21-15(13-9-5-2-6-10-13)19-20-14(17-18-16(20)22)11-12-7-3-1-4-8-12/h1-10H,11H2,(H,18,22)(H,19,21)