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

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-4-[5-methyl-1,3-bis(oxidanylidene)isoindol-2-yl]butanamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-2-methyl-phenyl]-4-(5-methyl-1,3-dioxo-isoindolin-2-yl)butanamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-2-methylphenyl]-4-(5-methyl-1,3-dioxo-2-isoindolyl)butanamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-2-methylphenyl]-4-(5-methyl-1,3-dioxoisoindol-2-yl)butanamide Traditional Name: 4-(1,3-diketo-5-methyl-isoindolin-2-yl)-N-[4-(4-ethylpiperazino)-2-methyl-phenyl]butyramide Formula: C26H32N4O3 MolecularWeight: 448.55728

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=CC(=C(C=C2)NC(=O)CCCN3C(=O)C4=C(C3=O)C=C(C=C4)C)C

InChI

InChI=1S/C26H32N4O3/c1-4-28-12-14-29(15-13-28)20-8-10-23(19(3)17-20)27-24(31)6-5-11-30-25(32)21-9-7-18(2)16-22(21)26(30)33/h7-10,16-17H,4-6,11-15H2,1-3H3,(H,27,31)