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

Systemtic Name: 4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)-1-[4-(diphenylmethyl)piperazin-1-yl]butan-1-one Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]butan-1-one CAS Name: 4-[5-chloro-2-(2-pyridinyl)-1H-indol-3-yl]-1-[4-(diphenylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-4-(5-chloro-2-pyridin-2-yl-1H-indol-3-yl)butan-1-one Traditional Name: 1-(4-benzhydrylpiperazino)-4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]butan-1-one Formula: C34H33ClN4O MolecularWeight: 549.10502

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCCC4=C(NC5=C4C=C(C=C5)Cl)C6=CC=CC=N6

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCCC4=C(NC5=C4C=C(C=C5)Cl)C6=CC=CC=N6

InChI

InChI=1S/C34H33ClN4O/c35-27-17-18-30-29(24-27)28(33(37-30)31-15-7-8-19-36-31)14-9-16-32(40)38-20-22-39(23-21-38)34(25-10-3-1-4-11-25)26-12-5-2-6-13-26/h1-8,10-13,15,17-19,24,34,37H,9,14,16,20-23H2