2-[[4-(3-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methyl-6-propan-2-yl-phenyl)ethanamide

Systemtic Name: 2-[[4-(3-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methyl-6-propan-2-yl-phenyl)ethanamide Openeye Name: N-(2-isopropyl-6-methyl-phenyl)-2-[[4-(m-tolyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-(3-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(2-methyl-6-propan-2-ylphenyl)acetamide IUPAC Name: 2-[[4-(3-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide Traditional Name: N-(2-isopropyl-6-methyl-phenyl)-2-[[4-(m-tolyl)-5-phenyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C27H28N4OS MolecularWeight: 456.60242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)NC3=C(C=CC=C3C(C)C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC(=O)NC3=C(C=CC=C3C(C)C)C)C4=CC=CC=C4

InChI

InChI=1S/C27H28N4OS/c1-18(2)23-15-9-11-20(4)25(23)28-24(32)17-33-27-30-29-26(21-12-6-5-7-13-21)31(27)22-14-8-10-19(3)16-22/h5-16,18H,17H2,1-4H3,(H,28,32)