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

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-2-[4-(phenylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]ethanamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-2-(4-benzyl-5-thioxo-1H-1,2,4-triazol-3-yl)acetamide CAS Name: N-(4-acetamido-3-chlorophenyl)-2-[4-(phenylmethyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-2-(4-benzyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)acetamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-2-(4-benzyl-5-thioxo-1H-1,2,4-triazol-3-yl)acetamide Formula: C19H18ClN5O2S MolecularWeight: 415.89652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)CC2=NNC(=S)N2CC3=CC=CC=C3)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)CC2=NNC(=S)N2CC3=CC=CC=C3)Cl

InChI

InChI=1S/C19H18ClN5O2S/c1-12(26)21-16-8-7-14(9-15(16)20)22-18(27)10-17-23-24-19(28)25(17)11-13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H,21,26)(H,22,27)(H,24,28)