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

Systemtic Name: 2-[5-[(3-chlorophenyl)methyl]-4-oxidanylidene-pyridazino[4,5-b]indol-3-yl]-N-cycloheptyl-ethanamide Openeye Name: 2-[5-[(3-chlorophenyl)methyl]-4-oxo-pyridazino[4,5-b]indol-3-yl]-N-cycloheptyl-acetamide CAS Name: 2-[5-[(3-chlorophenyl)methyl]-4-oxo-3-pyridazino[4,5-b]indolyl]-N-cycloheptylacetamide IUPAC Name: 2-[5-[(3-chlorophenyl)methyl]-4-oxopyridazino[4,5-b]indol-3-yl]-N-cycloheptylacetamide Traditional Name: 2-[5-(3-chlorobenzyl)-4-keto-pyridazin[4,5-b]indol-3-yl]-N-cycloheptyl-acetamide Formula: C26H27ClN4O2 MolecularWeight: 462.97118

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C26H27ClN4O2/c27-19-9-7-8-18(14-19)16-30-23-13-6-5-12-21(23)22-15-28-31(26(33)25(22)30)17-24(32)29-20-10-3-1-2-4-11-20/h5-9,12-15,20H,1-4,10-11,16-17H2,(H,29,32)