2-[(5-cyano-6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(4-dimethylaminophenyl)ethanamide

Systemtic Name: 2-[(5-cyano-6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(4-dimethylaminophenyl)ethanamide Openeye Name: 2-[(5-cyano-6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(4-dimethylaminophenyl)acetamide CAS Name: 2-[(5-cyano-6-ethyl-4-oxo-1H-pyrimidin-2-yl)thio]-N-(4-dimethylaminophenyl)acetamide IUPAC Name: 2-[(5-cyano-6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(4-dimethylaminophenyl)acetamide Traditional Name: 2-[(5-cyano-6-ethyl-4-keto-1H-pyrimidin-2-yl)thio]-N-(4-dimethylaminophenyl)acetamide Formula: C17H19N5O2S MolecularWeight: 357.43006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)N=C(N1)SCC(=O)NC2=CC=C(C=C2)N(C)C)C#N

Isomeric SMILES

CCC1=C(C(=O)N=C(N1)SCC(=O)NC2=CC=C(C=C2)N(C)C)C#N

InChI

InChI=1S/C17H19N5O2S/c1-4-14-13(9-18)16(24)21-17(20-14)25-10-15(23)19-11-5-7-12(8-6-11)22(2)3/h5-8H,4,10H2,1-3H3,(H,19,23)(H,20,21,24)