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

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-4-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butanamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-4-[6-oxo-3-(2-thienyl)pyridazin-1-yl]butanamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-4-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)butanamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-4-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)butanamide Traditional Name: 4-[6-keto-3-(2-thienyl)pyridazin-1-yl]-N-[2-(4-methoxyphenyl)ethyl]butyramide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CS3

InChI

InChI=1S/C21H23N3O3S/c1-27-17-8-6-16(7-9-17)12-13-22-20(25)5-2-14-24-21(26)11-10-18(23-24)19-4-3-15-28-19/h3-4,6-11,15H,2,5,12-14H2,1H3,(H,22,25)