3-(1,2-dimethylindol-3-yl)-2-[1-[4-(diphenylmethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-3H-isoindol-1-one

Systemtic Name: 3-(1,2-dimethylindol-3-yl)-2-[1-[4-(diphenylmethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]-3H-isoindol-1-one Openeye Name: 2-[2-(4-benzhydrylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]-3-(1,2-dimethylindol-3-yl)isoindolin-1-one CAS Name: 3-(1,2-dimethyl-3-indolyl)-2-[1-[4-(diphenylmethyl)-1-piperazinyl]-1-oxopropan-2-yl]-3H-isoindol-1-one IUPAC Name: 2-[1-(4-benzhydrylpiperazin-1-yl)-1-oxopropan-2-yl]-3-(1,2-dimethylindol-3-yl)-3H-isoindol-1-one Traditional Name: 2-[2-(4-benzhydrylpiperazino)-2-keto-1-methyl-ethyl]-3-(1,2-dimethylindol-3-yl)isoindolin-1-one Formula: C38H38N4O2 MolecularWeight: 582.73392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C)C3C4=CC=CC=C4C(=O)N3C(C)C(=O)N5CCN(CC5)C(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C)C3C4=CC=CC=C4C(=O)N3C(C)C(=O)N5CCN(CC5)C(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C38H38N4O2/c1-26-34(32-20-12-13-21-33(32)39(26)3)36-30-18-10-11-19-31(30)38(44)42(36)27(2)37(43)41-24-22-40(23-25-41)35(28-14-6-4-7-15-28)29-16-8-5-9-17-29/h4-21,27,35-36H,22-25H2,1-3H3