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

Systemtic Name: (3S)-2-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one Openeye Name: (3S)-2-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]-3-(2-phenyl-1H-indol-3-yl)isoindolin-1-one CAS Name: (3S)-2-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one IUPAC Name: (3S)-2-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-3-(2-phenyl-1H-indol-3-yl)-3H-isoindol-1-one Traditional Name: (3S)-2-[2-keto-2-(4-methylpiperazino)ethyl]-3-(2-phenyl-1H-indol-3-yl)isoindolin-1-one Formula: C29H28N4O2 MolecularWeight: 464.55822

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CN2C(C3=CC=CC=C3C2=O)C4=C(NC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

CN1CCN(CC1)C(=O)CN2[C@@H](C3=CC=CC=C3C2=O)C4=C(NC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C29H28N4O2/c1-31-15-17-32(18-16-31)25(34)19-33-28(21-11-5-6-12-22(21)29(33)35)26-23-13-7-8-14-24(23)30-27(26)20-9-3-2-4-10-20/h2-14,28,30H,15-19H2,1H3/t28-/m0/s1