N-(1-phenylbutan-2-yl)-1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-3-carboxamide

Systemtic Name: N-(1-phenylbutan-2-yl)-1-(1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-3-carboxamide Openeye Name: N-(1-benzylpropyl)-1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)piperidine-3-carboxamide CAS Name: 1-[oxo-[1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]methyl]-N-(1-phenylbutan-2-yl)-3-piperidinecarboxamide IUPAC Name: N-(1-phenylbutan-2-yl)-1-(1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidine-3-carboxamide Traditional Name: N-(1-benzylpropyl)-1-(1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)nipecotamide Formula: C30H33N5O2 MolecularWeight: 495.61532

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)NC(=O)C2CCCN(C2)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

CCC(CC1=CC=CC=C1)NC(=O)C2CCCN(C2)C(=O)C3=C(N(N=C3)C4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C30H33N5O2/c1-2-25(20-23-12-5-3-6-13-23)32-28(36)24-14-11-19-34(22-24)30(37)27-21-31-35(26-15-7-4-8-16-26)29(27)33-17-9-10-18-33/h3-10,12-13,15-18,21,24-25H,2,11,14,19-20,22H2,1H3,(H,32,36)