2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(3-methoxyphenyl)ethanamide

Systemtic Name: 2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(3-methoxyphenyl)acetamide CAS Name: 2-[(5-cyano-2-cyclopropyl-6-methyl-4-pyrimidinyl)thio]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-(5-cyano-2-cyclopropyl-6-methylpyrimidin-4-yl)sulfanyl-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)thio]-N-(3-methoxyphenyl)acetamide Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3=CC(=CC=C3)OC)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3=CC(=CC=C3)OC)C#N

InChI

InChI=1S/C18H18N4O2S/c1-11-15(9-19)18(22-17(20-11)12-6-7-12)25-10-16(23)21-13-4-3-5-14(8-13)24-2/h3-5,8,12H,6-7,10H2,1-2H3,(H,21,23)