N-(3,5-dimethylphenyl)-2-[5-methoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxidanylidene-pyridin-1-yl]ethanamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-[5-methoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxidanylidene-pyridin-1-yl]ethanamide Openeye Name: N-(3,5-dimethylphenyl)-2-[5-methoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxo-1-pyridyl]acetamide CAS Name: N-(3,5-dimethylphenyl)-2-[5-methoxy-2-[[(1-methyl-2-imidazolyl)thio]methyl]-4-oxo-1-pyridinyl]acetamide IUPAC Name: N-(3,5-dimethylphenyl)-2-[5-methoxy-2-[(1-methylimidazol-2-yl)sulfanylmethyl]-4-oxopyridin-1-yl]acetamide Traditional Name: N-(3,5-dimethylphenyl)-2-[4-keto-5-methoxy-2-[[(1-methylimidazol-2-yl)thio]methyl]-1-pyridyl]acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CN2C=C(C(=O)C=C2CSC3=NC=CN3C)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CN2C=C(C(=O)C=C2CSC3=NC=CN3C)OC)C

InChI

InChI=1S/C21H24N4O3S/c1-14-7-15(2)9-16(8-14)23-20(27)12-25-11-19(28-4)18(26)10-17(25)13-29-21-22-5-6-24(21)3/h5-11H,12-13H2,1-4H3,(H,23,27)