2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-oxidanylidene-pyridazin-1-yl]-N-(1-thiophen-2-ylethyl)ethanamide

Systemtic Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-oxidanylidene-pyridazin-1-yl]-N-(1-thiophen-2-ylethyl)ethanamide Openeye Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-oxo-pyridazin-1-yl]-N-[1-(2-thienyl)ethyl]acetamide CAS Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-oxo-1-pyridazinyl]-N-(1-thiophen-2-ylethyl)acetamide IUPAC Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-oxopyridazin-1-yl]-N-(1-thiophen-2-ylethyl)acetamide Traditional Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-6-keto-pyridazin-1-yl]-N-[1-(2-thienyl)ethyl]acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)CN2C(=O)C=C(C=N2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C1=CC=CS1)NC(=O)CN2C(=O)C=C(C=N2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H22N4O2S/c1-15(19-7-4-10-28-19)23-20(26)14-25-21(27)11-18(12-22-25)24-9-8-16-5-2-3-6-17(16)13-24/h2-7,10-12,15H,8-9,13-14H2,1H3,(H,23,26)