N-(2-ethyl-6-methyl-phenyl)-2-(4-oxidanylidene-3-prop-2-enyl-pyrido[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-(4-oxidanylidene-3-prop-2-enyl-pyrido[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-pyrido[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-[(4-oxo-3-prop-2-enyl-2-pyrido[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-(4-oxo-3-prop-2-enylpyrido[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-pyrido[2,3-d]pyrimidin-2-yl)thio]-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=C(C=CC=N3)C(=O)N2CC=C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=C(C=CC=N3)C(=O)N2CC=C)C

InChI

InChI=1S/C21H22N4O2S/c1-4-12-25-20(27)16-10-7-11-22-19(16)24-21(25)28-13-17(26)23-18-14(3)8-6-9-15(18)5-2/h4,6-11H,1,5,12-13H2,2-3H3,(H,23,26)