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

Systemtic Name: N-cycloheptyl-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-cycloheptyl-acetamide CAS Name: N-cycloheptyl-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-cycloheptylacetamide Traditional Name: 2-(5-benzyl-4-keto-pyridazin[4,5-b]indol-3-yl)-N-cycloheptyl-acetamide Formula: C26H28N4O2 MolecularWeight: 428.52612

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CN2C(=O)C3=C(C=N2)C4=CC=CC=C4N3CC5=CC=CC=C5

Isomeric SMILES

C1CCCC(CC1)NC(=O)CN2C(=O)C3=C(C=N2)C4=CC=CC=C4N3CC5=CC=CC=C5

InChI

InChI=1S/C26H28N4O2/c31-24(28-20-12-6-1-2-7-13-20)18-30-26(32)25-22(16-27-30)21-14-8-9-15-23(21)29(25)17-19-10-4-3-5-11-19/h3-5,8-11,14-16,20H,1-2,6-7,12-13,17-18H2,(H,28,31)