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

Systemtic Name: 4-[2-[(3-chlorophenyl)methyl]-3-sulfanylidene-1H-1,2,4-triazol-5-yl]benzamide Openeye Name: 4-[2-[(3-chlorophenyl)methyl]-3-thioxo-1H-1,2,4-triazol-5-yl]benzamide CAS Name: 4-[2-[(3-chlorophenyl)methyl]-3-sulfanylidene-1H-1,2,4-triazol-5-yl]benzamide IUPAC Name: 4-[2-[(3-chlorophenyl)methyl]-3-sulfanylidene-1H-1,2,4-triazol-5-yl]benzamide Traditional Name: 4-[2-(3-chlorobenzyl)-3-thioxo-1H-1,2,4-triazol-5-yl]benzamide Formula: C16H13ClN4OS MolecularWeight: 344.81862

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CN2C(=S)N=C(N2)C3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CN2C(=S)N=C(N2)C3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C16H13ClN4OS/c17-13-3-1-2-10(8-13)9-21-16(23)19-15(20-21)12-6-4-11(5-7-12)14(18)22/h1-8H,9H2,(H2,18,22)(H,19,20,23)