2-[[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenylbutan-2-yl)ethanamide

Systemtic Name: 2-[[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenylbutan-2-yl)ethanamide Openeye Name: 2-[[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(1-methyl-3-phenyl-propyl)acetamide CAS Name: 2-[[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(4-phenylbutan-2-yl)acetamide IUPAC Name: 2-[[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(4-phenylbutan-2-yl)acetamide Traditional Name: 2-[[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(1-methyl-3-phenyl-propyl)acetamide Formula: C20H21ClN4OS MolecularWeight: 400.92494

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)CSC2=NNC(=N2)C3=CC=CC=C3Cl

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)CSC2=NNC(=N2)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN4OS/c1-14(11-12-15-7-3-2-4-8-15)22-18(26)13-27-20-23-19(24-25-20)16-9-5-6-10-17(16)21/h2-10,14H,11-13H2,1H3,(H,22,26)(H,23,24,25)