2-[[5-(phenylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(4-propan-2-ylphenyl)ethanamide

Systemtic Name: 2-[[5-(phenylmethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(4-propan-2-ylphenyl)ethanamide Openeye Name: 2-[(5-benzyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-isopropylphenyl)acetamide CAS Name: 2-[[5-(phenylmethyl)-1H-1,2,4-triazol-3-yl]thio]-N-(4-propan-2-ylphenyl)acetamide IUPAC Name: 2-[(5-benzyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-propan-2-ylphenyl)acetamide Traditional Name: 2-[(5-benzyl-1H-1,2,4-triazol-3-yl)thio]-N-p-cumenyl-acetamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NNC(=N2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NNC(=N2)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N4OS/c1-14(2)16-8-10-17(11-9-16)21-19(25)13-26-20-22-18(23-24-20)12-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3,(H,21,25)(H,22,23,24)