3-[5-[2-cyanoethyl(phenyl)amino]-3-phenyl-3,4-dihydropyrazol-2-yl]-3-oxidanylidene-N-phenyl-propanamide

Systemtic Name: 3-[5-[2-cyanoethyl(phenyl)amino]-3-phenyl-3,4-dihydropyrazol-2-yl]-3-oxidanylidene-N-phenyl-propanamide Openeye Name: 3-[5-[N-(2-cyanoethyl)anilino]-3-phenyl-3,4-dihydropyrazol-2-yl]-3-oxo-N-phenyl-propanamide CAS Name: 3-[5-[N-(2-cyanoethyl)anilino]-3-phenyl-3,4-dihydropyrazol-2-yl]-3-oxo-N-phenylpropanamide IUPAC Name: 3-[5-[N-(2-cyanoethyl)anilino]-3-phenyl-3,4-dihydropyrazol-2-yl]-3-oxo-N-phenylpropanamide Traditional Name: 3-[3-[N-(2-cyanoethyl)anilino]-5-phenyl-2-pyrazolin-1-yl]-3-keto-N-phenyl-propionamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1N(CCC#N)C2=CC=CC=C2)C(=O)CC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C(N(N=C1N(CCC#N)C2=CC=CC=C2)C(=O)CC(=O)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N5O2/c28-17-10-18-31(23-15-8-3-9-16-23)25-19-24(21-11-4-1-5-12-21)32(30-25)27(34)20-26(33)29-22-13-6-2-7-14-22/h1-9,11-16,24H,10,18-20H2,(H,29,33)