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

Systemtic Name: N-[2-(phenylmethyl)phenyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-(2-benzylphenyl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-[2-(phenylmethyl)phenyl]-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-(2-benzylphenyl)-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(2-benzylphenyl)-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C21H18N4OS2 MolecularWeight: 406.52382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)CN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2NC(=O)CN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C21H18N4OS2/c26-19(14-25-20(23-24-21(25)27)18-11-6-12-28-18)22-17-10-5-4-9-16(17)13-15-7-2-1-3-8-15/h1-12H,13-14H2,(H,22,26)(H,24,27)