1-[4-(3-chlorophenyl)piperazin-1-yl]-4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butan-1-one

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butan-1-one Openeye Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-4-[5-methyl-2-(2-pyridyl)-1H-indol-3-yl]butan-1-one CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-4-[5-methyl-2-(2-pyridinyl)-1H-indol-3-yl]-1-butanone IUPAC Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butan-1-one Traditional Name: 1-[4-(3-chlorophenyl)piperazino]-4-[5-methyl-2-(2-pyridyl)-1H-indol-3-yl]butan-1-one Formula: C28H29ClN4O MolecularWeight: 473.00906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C5=CC=CC=N5

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C5=CC=CC=N5

InChI

InChI=1S/C28H29ClN4O/c1-20-11-12-25-24(18-20)23(28(31-25)26-9-2-3-13-30-26)8-5-10-27(34)33-16-14-32(15-17-33)22-7-4-6-21(29)19-22/h2-4,6-7,9,11-13,18-19,31H,5,8,10,14-17H2,1H3