N-(3-ethylphenyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-ethylphenyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(3-ethylphenyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)piperidine-4-carboxamide CAS Name: N-(3-ethylphenyl)-1-[[3-methyl-1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(3-ethylphenyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-(3-ethylphenyl)-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)isonipecotamide Formula: C29H31N5O2 MolecularWeight: 481.58874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)C2CCN(CC2)C(=O)C3=C(N(N=C3C)C4=CC=CC=C4)N5C=CC=C5

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)C2CCN(CC2)C(=O)C3=C(N(N=C3C)C4=CC=CC=C4)N5C=CC=C5

InChI

InChI=1S/C29H31N5O2/c1-3-22-10-9-11-24(20-22)30-27(35)23-14-18-33(19-15-23)29(36)26-21(2)31-34(25-12-5-4-6-13-25)28(26)32-16-7-8-17-32/h4-13,16-17,20,23H,3,14-15,18-19H2,1-2H3,(H,30,35)