3-[2-(4-ethylpiperazin-1-yl)-2-oxidanylidene-ethyl]-5-(phenylmethyl)pyridazino[4,5-b]indol-4-one

Systemtic Name: 3-[2-(4-ethylpiperazin-1-yl)-2-oxidanylidene-ethyl]-5-(phenylmethyl)pyridazino[4,5-b]indol-4-one Openeye Name: 5-benzyl-3-[2-(4-ethylpiperazin-1-yl)-2-oxo-ethyl]pyridazino[4,5-b]indol-4-one CAS Name: 3-[2-(4-ethyl-1-piperazinyl)-2-oxoethyl]-5-(phenylmethyl)-4-pyridazino[4,5-b]indolone IUPAC Name: 5-benzyl-3-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]pyridazino[4,5-b]indol-4-one Traditional Name: 5-benzyl-3-[2-(4-ethylpiperazino)-2-keto-ethyl]pyridazin[4,5-b]indol-4-one Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)CN2C(=O)C3=C(C=N2)C4=CC=CC=C4N3CC5=CC=CC=C5

Isomeric SMILES

CCN1CCN(CC1)C(=O)CN2C(=O)C3=C(C=N2)C4=CC=CC=C4N3CC5=CC=CC=C5

InChI

InChI=1S/C25H27N5O2/c1-2-27-12-14-28(15-13-27)23(31)18-30-25(32)24-21(16-26-30)20-10-6-7-11-22(20)29(24)17-19-8-4-3-5-9-19/h3-11,16H,2,12-15,17-18H2,1H3