5-methyl-3-(4-methylphenyl)-4-oxidanylidene-N-(3-pyrrolidin-1-ylpropyl)pyridazino[4,5-b]indole-1-carboxamide

Systemtic Name: 5-methyl-3-(4-methylphenyl)-4-oxidanylidene-N-(3-pyrrolidin-1-ylpropyl)pyridazino[4,5-b]indole-1-carboxamide Openeye Name: 5-methyl-4-oxo-3-(p-tolyl)-N-(3-pyrrolidin-1-ylpropyl)pyridazino[4,5-b]indole-1-carboxamide CAS Name: 5-methyl-3-(4-methylphenyl)-4-oxo-N-[3-(1-pyrrolidinyl)propyl]-1-pyridazino[4,5-b]indolecarboxamide IUPAC Name: 5-methyl-3-(4-methylphenyl)-4-oxo-N-(3-pyrrolidin-1-ylpropyl)pyridazino[4,5-b]indole-1-carboxamide Traditional Name: 4-keto-5-methyl-3-(p-tolyl)-N-(3-pyrrolidinopropyl)pyridazin[4,5-b]indole-1-carboxamide Formula: C26H29N5O2 MolecularWeight: 443.54076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3C)C(=N2)C(=O)NCCCN5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4N3C)C(=N2)C(=O)NCCCN5CCCC5

InChI

InChI=1S/C26H29N5O2/c1-18-10-12-19(13-11-18)31-26(33)24-22(20-8-3-4-9-21(20)29(24)2)23(28-31)25(32)27-14-7-17-30-15-5-6-16-30/h3-4,8-13H,5-7,14-17H2,1-2H3,(H,27,32)