3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(1,4-diphenylbutyl)propanamide

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(1,4-diphenylbutyl)propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(1,4-diphenylbutyl)propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-(1,4-diphenylbutyl)propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-(1,4-diphenylbutyl)propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(1,4-diphenylbutyl)propionamide Formula: C27H32N4O MolecularWeight: 428.56918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)NC(CCCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)NC(CCCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H32N4O/c1-21-25(22(2)31(30-21)20-10-19-28)17-18-27(32)29-26(24-14-7-4-8-15-24)16-9-13-23-11-5-3-6-12-23/h3-8,11-12,14-15,26H,9-10,13,16-18,20H2,1-2H3,(H,29,32)