4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-(5-chloranyl-2-quinolin-2-yl-1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)butan-1-one Openeye Name: 4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]-1-(4-methylpiperazin-1-yl)butan-1-one CAS Name: 4-[5-chloro-2-(2-quinolinyl)-1H-indol-3-yl]-1-(4-methyl-1-piperazinyl)-1-butanone IUPAC Name: 4-(5-chloro-2-quinolin-2-yl-1H-indol-3-yl)-1-(4-methylpiperazin-1-yl)butan-1-one Traditional Name: 4-[5-chloro-2-(2-quinolyl)-1H-indol-3-yl]-1-(4-methylpiperazino)butan-1-one Formula: C26H27ClN4O MolecularWeight: 446.97178

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CCCC2=C(NC3=C2C=C(C=C3)Cl)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CN1CCN(CC1)C(=O)CCCC2=C(NC3=C2C=C(C=C3)Cl)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H27ClN4O/c1-30-13-15-31(16-14-30)25(32)8-4-6-20-21-17-19(27)10-12-23(21)29-26(20)24-11-9-18-5-2-3-7-22(18)28-24/h2-3,5,7,9-12,17,29H,4,6,8,13-16H2,1H3