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

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-(2-chloro-4-methylphenyl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide IUPAC Name: N-(2-chloro-4-methylphenyl)-2-[3-(3-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetamide Traditional Name: N-(2-chloro-4-methyl-phenyl)-2-[3-(m-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C18H17ClN4OS MolecularWeight: 372.87178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CN2C(=NNC2=S)C3=CC(=CC=C3)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CN2C(=NNC2=S)C3=CC(=CC=C3)C)Cl

InChI

InChI=1S/C18H17ClN4OS/c1-11-4-3-5-13(8-11)17-21-22-18(25)23(17)10-16(24)20-15-7-6-12(2)9-14(15)19/h3-9H,10H2,1-2H3,(H,20,24)(H,22,25)