2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)ethanamide Openeye Name: 2-(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(4-morpholinosulfonylphenyl)acetamide CAS Name: 2-[(5-cyano-2-cyclopropyl-6-methyl-4-pyrimidinyl)thio]-N-[4-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(5-cyano-2-cyclopropyl-6-methylpyrimidin-4-yl)sulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[(5-cyano-2-cyclopropyl-6-methyl-pyrimidin-4-yl)thio]-N-(4-morpholinosulfonylphenyl)acetamide Formula: C21H23N5O4S2 MolecularWeight: 473.56842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C2CC2)SCC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C#N

InChI

InChI=1S/C21H23N5O4S2/c1-14-18(12-22)21(25-20(23-14)15-2-3-15)31-13-19(27)24-16-4-6-17(7-5-16)32(28,29)26-8-10-30-11-9-26/h4-7,15H,2-3,8-11,13H2,1H3,(H,24,27)