3-(4-methoxyphenyl)-5-methyl-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]carbonyl-pyridazino[4,5-b]indol-4-one

Systemtic Name: 3-(4-methoxyphenyl)-5-methyl-1-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]carbonyl-pyridazino[4,5-b]indol-4-one Openeye Name: 3-(4-methoxyphenyl)-5-methyl-1-[3-methyl-4-(m-tolyl)piperazine-1-carbonyl]pyridazino[4,5-b]indol-4-one CAS Name: 3-(4-methoxyphenyl)-5-methyl-1-[[3-methyl-4-(3-methylphenyl)-1-piperazinyl]-oxomethyl]-4-pyridazino[4,5-b]indolone IUPAC Name: 3-(4-methoxyphenyl)-5-methyl-1-[3-methyl-4-(3-methylphenyl)piperazine-1-carbonyl]pyridazino[4,5-b]indol-4-one Traditional Name: 3-(4-methoxyphenyl)-5-methyl-1-[3-methyl-4-(m-tolyl)piperazine-1-carbonyl]pyridazin[4,5-b]indol-4-one Formula: C31H31N5O3 MolecularWeight: 521.60954

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3=NN(C(=O)C4=C3C5=CC=CC=C5N4C)C6=CC=C(C=C6)OC

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3=NN(C(=O)C4=C3C5=CC=CC=C5N4C)C6=CC=C(C=C6)OC

InChI

InChI=1S/C31H31N5O3/c1-20-8-7-9-23(18-20)35-17-16-34(19-21(35)2)30(37)28-27-25-10-5-6-11-26(25)33(3)29(27)31(38)36(32-28)22-12-14-24(39-4)15-13-22/h5-15,18,21H,16-17,19H2,1-4H3