2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-[2-(3-methylphenoxy)ethyl]ethanamide

Systemtic Name: 2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-[2-(3-methylphenoxy)ethyl]ethanamide Openeye Name: 2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-[2-(3-methylphenoxy)ethyl]acetamide CAS Name: 2-[(5-cyano-2-cyclopropyl-6-methyl-4-pyrimidinyl)thio]-N-[2-(3-methylphenoxy)ethyl]acetamide IUPAC Name: 2-(5-cyano-2-cyclopropyl-6-methylpyrimidin-4-yl)sulfanyl-N-[2-(3-methylphenoxy)ethyl]acetamide Traditional Name: 2-[(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)thio]-N-[2-(3-methylphenoxy)ethyl]acetamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)CSC2=NC(=NC(=C2C#N)C)C3CC3

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)CSC2=NC(=NC(=C2C#N)C)C3CC3

InChI

InChI=1S/C20H22N4O2S/c1-13-4-3-5-16(10-13)26-9-8-22-18(25)12-27-20-17(11-21)14(2)23-19(24-20)15-6-7-15/h3-5,10,15H,6-9,12H2,1-2H3,(H,22,25)