[4-[2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrol-3-yl]carbonylpiperazin-1-yl]-(4-propan-2-ylphenyl)methanone

Systemtic Name: [4-[2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrol-3-yl]carbonylpiperazin-1-yl]-(4-propan-2-ylphenyl)methanone Openeye Name: [4-[2,5-dimethyl-1-(2-pyridylmethyl)pyrrole-3-carbonyl]piperazin-1-yl]-(4-isopropylphenyl)methanone CAS Name: [4-[[2,5-dimethyl-1-(2-pyridinylmethyl)-3-pyrrolyl]-oxomethyl]-1-piperazinyl]-(4-propan-2-ylphenyl)methanone IUPAC Name: [4-[2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrole-3-carbonyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone Traditional Name: [4-[2,5-dimethyl-1-(2-pyridylmethyl)pyrrole-3-carbonyl]piperazino]-p-cumenyl-methanone Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=N2)C)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=N2)C)C(=O)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C27H32N4O2/c1-19(2)22-8-10-23(11-9-22)26(32)29-13-15-30(16-14-29)27(33)25-17-20(3)31(21(25)4)18-24-7-5-6-12-28-24/h5-12,17,19H,13-16,18H2,1-4H3