N-(2-ethyl-6-methyl-phenyl)-2-[4-oxidanylidene-5-(phenylmethyl)pyridazino[4,5-b]indol-3-yl]ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-[4-oxidanylidene-5-(phenylmethyl)pyridazino[4,5-b]indol-3-yl]ethanamide Openeye Name: 2-(5-benzyl-4-oxo-pyridazino[4,5-b]indol-3-yl)-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-[4-oxo-5-(phenylmethyl)-3-pyridazino[4,5-b]indolyl]acetamide IUPAC Name: 2-(5-benzyl-4-oxopyridazino[4,5-b]indol-3-yl)-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: 2-(5-benzyl-4-keto-pyridazin[4,5-b]indol-3-yl)-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C28H26N4O2 MolecularWeight: 450.53164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CN2C(=O)C3=C(C=N2)C4=CC=CC=C4N3CC5=CC=CC=C5)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CN2C(=O)C3=C(C=N2)C4=CC=CC=C4N3CC5=CC=CC=C5)C

InChI

InChI=1S/C28H26N4O2/c1-3-21-13-9-10-19(2)26(21)30-25(33)18-32-28(34)27-23(16-29-32)22-14-7-8-15-24(22)31(27)17-20-11-5-4-6-12-20/h4-16H,3,17-18H2,1-2H3,(H,30,33)