N-(3,4-dimethylphenyl)-4-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butanamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)butanamide Openeye Name: N-(3,4-dimethylphenyl)-4-[6-oxo-3-(2-thienyl)pyridazin-1-yl]butanamide CAS Name: N-(3,4-dimethylphenyl)-4-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)butanamide IUPAC Name: N-(3,4-dimethylphenyl)-4-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)butanamide Traditional Name: N-(3,4-dimethylphenyl)-4-[6-keto-3-(2-thienyl)pyridazin-1-yl]butyramide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCCN2C(=O)C=CC(=N2)C3=CC=CS3)C

InChI

InChI=1S/C20H21N3O2S/c1-14-7-8-16(13-15(14)2)21-19(24)6-3-11-23-20(25)10-9-17(22-23)18-5-4-12-26-18/h4-5,7-10,12-13H,3,6,11H2,1-2H3,(H,21,24)