2-[4-methyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)pentan-2-yl]-3-(1-methyl-2-phenyl-indol-3-yl)-3H-isoindol-1-one

Systemtic Name: 2-[4-methyl-1-oxidanylidene-1-(4-phenylpiperazin-1-yl)pentan-2-yl]-3-(1-methyl-2-phenyl-indol-3-yl)-3H-isoindol-1-one Openeye Name: 3-(1-methyl-2-phenyl-indol-3-yl)-2-[3-methyl-1-(4-phenylpiperazine-1-carbonyl)butyl]isoindolin-1-one CAS Name: 2-[4-methyl-1-oxo-1-(4-phenyl-1-piperazinyl)pentan-2-yl]-3-(1-methyl-2-phenyl-3-indolyl)-3H-isoindol-1-one IUPAC Name: 2-[4-methyl-1-oxo-1-(4-phenylpiperazin-1-yl)pentan-2-yl]-3-(1-methyl-2-phenylindol-3-yl)-3H-isoindol-1-one Traditional Name: 3-(1-methyl-2-phenyl-indol-3-yl)-2-[3-methyl-1-(4-phenylpiperazine-1-carbonyl)butyl]isoindolin-1-one Formula: C39H40N4O2 MolecularWeight: 596.7605

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)N3C(C4=CC=CC=C4C3=O)C5=C(N(C6=CC=CC=C65)C)C7=CC=CC=C7

Isomeric SMILES

CC(C)CC(C(=O)N1CCN(CC1)C2=CC=CC=C2)N3C(C4=CC=CC=C4C3=O)C5=C(N(C6=CC=CC=C65)C)C7=CC=CC=C7

InChI

InChI=1S/C39H40N4O2/c1-27(2)26-34(39(45)42-24-22-41(23-25-42)29-16-8-5-9-17-29)43-37(30-18-10-11-19-31(30)38(43)44)35-32-20-12-13-21-33(32)40(3)36(35)28-14-6-4-7-15-28/h4-21,27,34,37H,22-26H2,1-3H3