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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazol-4-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[(4-methoxyphenyl)methyl]-1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)piperidine-4-carboxamide CAS Name: N-[(4-methoxyphenyl)methyl]-1-[[3-methyl-1-phenyl-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-1-(3-methyl-1-phenyl-5-pyrrol-1-ylpyrazole-4-carbonyl)piperidine-4-carboxamide Traditional Name: 1-(3-methyl-1-phenyl-5-pyrrol-1-yl-pyrazole-4-carbonyl)-N-p-anisyl-isonipecotamide Formula: C29H31N5O3 MolecularWeight: 497.58814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)OC)N4C=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)OC)N4C=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H31N5O3/c1-21-26(28(32-16-6-7-17-32)34(31-21)24-8-4-3-5-9-24)29(36)33-18-14-23(15-19-33)27(35)30-20-22-10-12-25(37-2)13-11-22/h3-13,16-17,23H,14-15,18-20H2,1-2H3,(H,30,35)