N-butyl-3-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-propanamide

Systemtic Name: N-butyl-3-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-propanamide Openeye Name: N-butyl-3-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-propanamide CAS Name: N-butyl-3-[[4-(4-methoxyphenyl)-6-(trifluoromethyl)-2-pyrimidinyl]sulfonyl]propanamide IUPAC Name: N-butyl-3-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonylpropanamide Traditional Name: N-butyl-3-[4-(4-methoxyphenyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-propionamide Formula: C19H22F3N3O4S MolecularWeight: 445.45589

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CCS(=O)(=O)C1=NC(=CC(=N1)C(F)(F)F)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCNC(=O)CCS(=O)(=O)C1=NC(=CC(=N1)C(F)(F)F)C2=CC=C(C=C2)OC

InChI

InChI=1S/C19H22F3N3O4S/c1-3-4-10-23-17(26)9-11-30(27,28)18-24-15(12-16(25-18)19(20,21)22)13-5-7-14(29-2)8-6-13/h5-8,12H,3-4,9-11H2,1-2H3,(H,23,26)