2-(5-methyl-4-oxidanylidene-pyridazino[4,5-b]indol-3-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide

Systemtic Name: 2-(5-methyl-4-oxidanylidene-pyridazino[4,5-b]indol-3-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]ethanamide Openeye Name: 2-(5-methyl-4-oxo-pyridazino[4,5-b]indol-3-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide CAS Name: 2-(5-methyl-4-oxo-3-pyridazino[4,5-b]indolyl)-N-[3-(4-methyl-1-piperazinyl)propyl]acetamide IUPAC Name: 2-(5-methyl-4-oxopyridazino[4,5-b]indol-3-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]acetamide Traditional Name: 2-(4-keto-5-methyl-pyridazin[4,5-b]indol-3-yl)-N-[3-(4-methylpiperazino)propyl]acetamide Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC(=O)CN2C(=O)C3=C(C=N2)C4=CC=CC=C4N3C

Isomeric SMILES

CN1CCN(CC1)CCCNC(=O)CN2C(=O)C3=C(C=N2)C4=CC=CC=C4N3C

InChI

InChI=1S/C21H28N6O2/c1-24-10-12-26(13-11-24)9-5-8-22-19(28)15-27-21(29)20-17(14-23-27)16-6-3-4-7-18(16)25(20)2/h3-4,6-7,14H,5,8-13,15H2,1-2H3,(H,22,28)