9-methyl-2-(2-methylpropyl)-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-pyrido[3,4-b]indol-1-one

Systemtic Name: 9-methyl-2-(2-methylpropyl)-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-pyrido[3,4-b]indol-1-one Openeye Name: 2-isobutyl-9-methyl-4-[4-(2-pyridyl)piperazine-1-carbonyl]pyrido[3,4-b]indol-1-one CAS Name: 9-methyl-2-(2-methylpropyl)-4-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-1-pyrido[3,4-b]indolone IUPAC Name: 9-methyl-2-(2-methylpropyl)-4-(4-pyridin-2-ylpiperazine-1-carbonyl)pyrido[3,4-b]indol-1-one Traditional Name: 2-isobutyl-9-methyl-4-[4-(2-pyridyl)piperazine-1-carbonyl]-$b-carbolin-1-one Formula: C26H29N5O2 MolecularWeight: 443.54076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=C(C2=C(C1=O)N(C3=CC=CC=C32)C)C(=O)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CC(C)CN1C=C(C2=C(C1=O)N(C3=CC=CC=C32)C)C(=O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C26H29N5O2/c1-18(2)16-31-17-20(23-19-8-4-5-9-21(19)28(3)24(23)26(31)33)25(32)30-14-12-29(13-15-30)22-10-6-7-11-27-22/h4-11,17-18H,12-16H2,1-3H3