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

Systemtic Name: 3-(1-methylindol-3-yl)-2-[3-methyl-1-(4-methylpiperazin-1-yl)-1-oxidanylidene-pentan-2-yl]-3H-isoindol-1-one Openeye Name: 3-(1-methylindol-3-yl)-2-[2-methyl-1-(4-methylpiperazine-1-carbonyl)butyl]isoindolin-1-one CAS Name: 3-(1-methyl-3-indolyl)-2-[3-methyl-1-(4-methyl-1-piperazinyl)-1-oxopentan-2-yl]-3H-isoindol-1-one IUPAC Name: 3-(1-methylindol-3-yl)-2-[3-methyl-1-(4-methylpiperazin-1-yl)-1-oxopentan-2-yl]-3H-isoindol-1-one Traditional Name: 3-(1-methylindol-3-yl)-2-[2-methyl-1-(4-methylpiperazine-1-carbonyl)butyl]isoindolin-1-one Formula: C28H34N4O2 MolecularWeight: 458.59516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCN(CC1)C)N2C(C3=CC=CC=C3C2=O)C4=CN(C5=CC=CC=C54)C

Isomeric SMILES

CCC(C)C(C(=O)N1CCN(CC1)C)N2C(C3=CC=CC=C3C2=O)C4=CN(C5=CC=CC=C54)C

InChI

InChI=1S/C28H34N4O2/c1-5-19(2)25(28(34)31-16-14-29(3)15-17-31)32-26(21-11-6-7-12-22(21)27(32)33)23-18-30(4)24-13-9-8-10-20(23)24/h6-13,18-19,25-26H,5,14-17H2,1-4H3