2-(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-[2-(3,4-diethoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-[2-(3,4-diethoxyphenyl)ethyl]ethanamide Openeye Name: 2-(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide CAS Name: 2-[(5-cyano-2,6-dimethyl-4-pyrimidinyl)thio]-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide IUPAC Name: 2-(5-cyano-2,6-dimethylpyrimidin-4-yl)sulfanyl-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide Traditional Name: 2-[(5-cyano-2,6-dimethyl-pyrimidin-4-yl)thio]-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NC(=NC(=C2C#N)C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NC(=NC(=C2C#N)C)C)OCC

InChI

InChI=1S/C21H26N4O3S/c1-5-27-18-8-7-16(11-19(18)28-6-2)9-10-23-20(26)13-29-21-17(12-22)14(3)24-15(4)25-21/h7-8,11H,5-6,9-10,13H2,1-4H3,(H,23,26)