4-[3-(3-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(thiophen-2-ylmethyl)butanamide

Systemtic Name: 4-[3-(3-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(thiophen-2-ylmethyl)butanamide Openeye Name: 4-[3-(3-methoxyphenyl)-6-oxo-pyridazin-1-yl]-N-(2-thienylmethyl)butanamide CAS Name: 4-[3-(3-methoxyphenyl)-6-oxo-1-pyridazinyl]-N-(thiophen-2-ylmethyl)butanamide IUPAC Name: 4-[3-(3-methoxyphenyl)-6-oxopyridazin-1-yl]-N-(thiophen-2-ylmethyl)butanamide Traditional Name: 4-[6-keto-3-(3-methoxyphenyl)pyridazin-1-yl]-N-(2-thenyl)butyramide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C(=O)C=C2)CCCC(=O)NCC3=CC=CS3

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C(=O)C=C2)CCCC(=O)NCC3=CC=CS3

InChI

InChI=1S/C20H21N3O3S/c1-26-16-6-2-5-15(13-16)18-9-10-20(25)23(22-18)11-3-8-19(24)21-14-17-7-4-12-27-17/h2,4-7,9-10,12-13H,3,8,11,14H2,1H3,(H,21,24)