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

Systemtic Name: N-(2-phenylpropyl)-2-[[4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-(4-isopropylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-phenylpropyl)acetamide CAS Name: N-(2-phenylpropyl)-2-[[4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-phenylpropyl)-2-[[4-(4-propan-2-ylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[(4-p-cumenyl-1,2,4-triazol-3-yl)thio]-N-(2-phenylpropyl)acetamide Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C=NN=C2SCC(=O)NCC(C)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C=NN=C2SCC(=O)NCC(C)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4OS/c1-16(2)18-9-11-20(12-10-18)26-15-24-25-22(26)28-14-21(27)23-13-17(3)19-7-5-4-6-8-19/h4-12,15-17H,13-14H2,1-3H3,(H,23,27)