N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide Openeye Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide CAS Name: N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide IUPAC Name: N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide Traditional Name: N-(4-methyl-3-morpholinosulfonyl-phenyl)-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]propionamide Formula: C19H21F3N4O4S2 MolecularWeight: 490.51965

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC=CC(=N2)C(F)(F)F)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC=CC(=N2)C(F)(F)F)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H21F3N4O4S2/c1-12-3-4-14(11-15(12)32(28,29)26-7-9-30-10-8-26)24-17(27)13(2)31-18-23-6-5-16(25-18)19(20,21)22/h3-6,11,13H,7-10H2,1-2H3,(H,24,27)