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

Systemtic Name: 2-[3-methyl-1-(4-methylpiperazin-1-yl)-1-oxidanylidene-pentan-2-yl]-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one Openeye Name: 2-[2-methyl-1-(4-methylpiperazine-1-carbonyl)butyl]-3-(2-phenyl-1H-indol-3-yl)isoindolin-1-one CAS Name: 2-[3-methyl-1-(4-methyl-1-piperazinyl)-1-oxopentan-2-yl]-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one IUPAC Name: 2-[3-methyl-1-(4-methylpiperazin-1-yl)-1-oxopentan-2-yl]-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one Traditional Name: 2-[2-methyl-1-(4-methylpiperazine-1-carbonyl)butyl]-3-(2-phenyl-1H-indol-3-yl)isoindolin-1-one Formula: C33H36N4O2 MolecularWeight: 520.66454

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C)N2C(C3=CC=CC=C3C2=O)C4=C(NC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(CC1)C)N2C(C3=CC=CC=C3C2=O)C4=C(NC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C33H36N4O2/c1-4-22(2)30(33(39)36-20-18-35(3)19-21-36)37-31(24-14-8-9-15-25(24)32(37)38)28-26-16-10-11-17-27(26)34-29(28)23-12-6-5-7-13-23/h5-17,22,30-31,34H,4,18-21H2,1-3H3