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

Systemtic Name: 2-[4-oxidanylidene-5-(phenylmethyl)pyridazino[4,5-b]indol-3-yl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-(5-benzyl-4-oxo-pyridazino[4,5-b]indol-3-yl)-N-(2-thienylmethyl)acetamide CAS Name: 2-[4-oxo-5-(phenylmethyl)-3-pyridazino[4,5-b]indolyl]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-(5-benzyl-4-oxopyridazino[4,5-b]indol-3-yl)-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-(5-benzyl-4-keto-pyridazin[4,5-b]indol-3-yl)-N-(2-thenyl)acetamide Formula: C24H20N4O2S MolecularWeight: 428.5062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C2C(=O)N(N=C4)CC(=O)NCC5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3C4=C2C(=O)N(N=C4)CC(=O)NCC5=CC=CS5

InChI

InChI=1S/C24H20N4O2S/c29-22(25-13-18-9-6-12-31-18)16-28-24(30)23-20(14-26-28)19-10-4-5-11-21(19)27(23)15-17-7-2-1-3-8-17/h1-12,14H,13,15-16H2,(H,25,29)