2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)ethanamide

Systemtic Name: 2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)ethanamide Openeye Name: 2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)acetamide CAS Name: 2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-(1-phenylethyl)acetamide IUPAC Name: 2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-phenylethyl)acetamide Traditional Name: 2-[[5-(3,4-dimethylphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]-N-(1-phenylethyl)acetamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(N2C)SCC(=O)NC(C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(N2C)SCC(=O)NC(C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H24N4OS/c1-14-10-11-18(12-15(14)2)20-23-24-21(25(20)4)27-13-19(26)22-16(3)17-8-6-5-7-9-17/h5-12,16H,13H2,1-4H3,(H,22,26)