1-(3-methylphenyl)-N-[3-(4-piperidin-1-ylpiperidin-1-yl)propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(3-methylphenyl)-N-[3-(4-piperidin-1-ylpiperidin-1-yl)propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Openeye Name: 1-(m-tolyl)-N-[3-[4-(1-piperidyl)-1-piperidyl]propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide CAS Name: 1-(3-methylphenyl)-N-[3-[4-(1-piperidinyl)-1-piperidinyl]propyl]-5-(1-pyrrolyl)-4-pyrazolecarboxamide IUPAC Name: 1-(3-methylphenyl)-N-[3-(4-piperidin-1-ylpiperidin-1-yl)propyl]-5-pyrrol-1-ylpyrazole-4-carboxamide Traditional Name: 1-(m-tolyl)-N-[3-(4-piperidinopiperidino)propyl]-5-pyrrol-1-yl-pyrazole-4-carboxamide Formula: C28H38N6O MolecularWeight: 474.64092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NCCCN3CCC(CC3)N4CCCCC4)N5C=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C(C=N2)C(=O)NCCCN3CCC(CC3)N4CCCCC4)N5C=CC=C5

InChI

InChI=1S/C28H38N6O/c1-23-9-7-10-25(21-23)34-28(33-17-5-6-18-33)26(22-30-34)27(35)29-13-8-14-31-19-11-24(12-20-31)32-15-3-2-4-16-32/h5-7,9-10,17-18,21-22,24H,2-4,8,11-16,19-20H2,1H3,(H,29,35)