4-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-phenylpiperazin-1-yl)ethyl]butanamide

Systemtic Name: 4-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-phenylpiperazin-1-yl)ethyl]butanamide Openeye Name: 4-(5-methyl-1,3-dioxo-isoindolin-2-yl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]butanamide CAS Name: 4-(5-methyl-1,3-dioxo-2-isoindolyl)-N-[2-(4-phenyl-1-piperazinyl)ethyl]butanamide IUPAC Name: 4-(5-methyl-1,3-dioxoisoindol-2-yl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]butanamide Traditional Name: 4-(1,3-diketo-5-methyl-isoindolin-2-yl)-N-[2-(4-phenylpiperazino)ethyl]butyramide Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)NCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C2=O)CCCC(=O)NCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H30N4O3/c1-19-9-10-21-22(18-19)25(32)29(24(21)31)12-5-8-23(30)26-11-13-27-14-16-28(17-15-27)20-6-3-2-4-7-20/h2-4,6-7,9-10,18H,5,8,11-17H2,1H3,(H,26,30)