N-(4-methylpiperazin-1-yl)-1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxamide

Systemtic Name: N-(4-methylpiperazin-1-yl)-1,3-bis(oxidanylidene)-2-(phenylmethyl)isoindole-5-carboxamide Openeye Name: 2-benzyl-N-(4-methylpiperazin-1-yl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(4-methyl-1-piperazinyl)-1,3-dioxo-2-(phenylmethyl)-5-isoindolecarboxamide IUPAC Name: 2-benzyl-N-(4-methylpiperazin-1-yl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-benzyl-1,3-diketo-N-(4-methylpiperazino)isoindoline-5-carboxamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CC=C4

InChI

InChI=1S/C21H22N4O3/c1-23-9-11-24(12-10-23)22-19(26)16-7-8-17-18(13-16)21(28)25(20(17)27)14-15-5-3-2-4-6-15/h2-8,13H,9-12,14H2,1H3,(H,22,26)