5-[[5-(4-methylpiperazin-1-yl)-1,3-dihydroisoindol-2-yl]carbonyl]-3-propyl-1,2-dihydroindazol-6-one

Systemtic Name: 5-[[5-(4-methylpiperazin-1-yl)-1,3-dihydroisoindol-2-yl]carbonyl]-3-propyl-1,2-dihydroindazol-6-one Openeye Name: 5-[5-(4-methylpiperazin-1-yl)isoindoline-2-carbonyl]-3-propyl-1,2-dihydroindazol-6-one CAS Name: 5-[[5-(4-methyl-1-piperazinyl)-1,3-dihydroisoindol-2-yl]-oxomethyl]-3-propyl-1,2-dihydroindazol-6-one IUPAC Name: 5-[5-(4-methylpiperazin-1-yl)-1,3-dihydroisoindole-2-carbonyl]-3-propyl-1,2-dihydroindazol-6-one Traditional Name: 5-[5-(4-methylpiperazino)isoindoline-2-carbonyl]-3-propyl-1,2-dihydroindazol-6-one Formula: C24H29N5O2 MolecularWeight: 419.51936

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C=C(C(=O)C=C2NN1)C(=O)N3CC4=C(C3)C=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CCCC1=C2C=C(C(=O)C=C2NN1)C(=O)N3CC4=C(C3)C=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C24H29N5O2/c1-3-4-21-19-12-20(23(30)13-22(19)26-25-21)24(31)29-14-16-5-6-18(11-17(16)15-29)28-9-7-27(2)8-10-28/h5-6,11-13,25-26H,3-4,7-10,14-15H2,1-2H3