2-[4-oxidanylidene-5-(phenylmethyl)pyridazino[4,5-b]indol-3-yl]-N-(1-phenylbutan-2-yl)ethanamide

Systemtic Name: 2-[4-oxidanylidene-5-(phenylmethyl)pyridazino[4,5-b]indol-3-yl]-N-(1-phenylbutan-2-yl)ethanamide Openeye Name: 2-(5-benzyl-4-oxo-pyridazino[4,5-b]indol-3-yl)-N-(1-benzylpropyl)acetamide CAS Name: 2-[4-oxo-5-(phenylmethyl)-3-pyridazino[4,5-b]indolyl]-N-(1-phenylbutan-2-yl)acetamide IUPAC Name: 2-(5-benzyl-4-oxopyridazino[4,5-b]indol-3-yl)-N-(1-phenylbutan-2-yl)acetamide Traditional Name: 2-(5-benzyl-4-keto-pyridazin[4,5-b]indol-3-yl)-N-(1-benzylpropyl)acetamide Formula: C29H28N4O2 MolecularWeight: 464.55822

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)NC(=O)CN2C(=O)C3=C(C=N2)C4=CC=CC=C4N3CC5=CC=CC=C5

Isomeric SMILES

CCC(CC1=CC=CC=C1)NC(=O)CN2C(=O)C3=C(C=N2)C4=CC=CC=C4N3CC5=CC=CC=C5

InChI

InChI=1S/C29H28N4O2/c1-2-23(17-21-11-5-3-6-12-21)31-27(34)20-33-29(35)28-25(18-30-33)24-15-9-10-16-26(24)32(28)19-22-13-7-4-8-14-22/h3-16,18,23H,2,17,19-20H2,1H3,(H,31,34)