5-[furan-2-ylmethyl-(phenylmethyl)amino]-2-methylsulfonyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide

Systemtic Name: 5-[furan-2-ylmethyl-(phenylmethyl)amino]-2-methylsulfonyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide Openeye Name: 5-[benzyl(2-furylmethyl)amino]-2-methylsulfonyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide CAS Name: 5-[2-furanylmethyl-(phenylmethyl)amino]-2-methylsulfonyl-N-[3-(trifluoromethyl)phenyl]-4-pyrimidinecarboxamide IUPAC Name: 5-[benzyl(furan-2-ylmethyl)amino]-2-methylsulfonyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide Traditional Name: 5-[benzyl(2-furfuryl)amino]-2-mesyl-N-[3-(trifluoromethyl)phenyl]pyrimidine-4-carboxamide Formula: C25H21F3N4O4S MolecularWeight: 530.51885

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=CC=CC(=C2)C(F)(F)F)N(CC3=CC=CC=C3)CC4=CC=CO4

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=CC=CC(=C2)C(F)(F)F)N(CC3=CC=CC=C3)CC4=CC=CO4

InChI

InChI=1S/C25H21F3N4O4S/c1-37(34,35)24-29-14-21(32(16-20-11-6-12-36-20)15-17-7-3-2-4-8-17)22(31-24)23(33)30-19-10-5-9-18(13-19)25(26,27)28/h2-14H,15-16H2,1H3,(H,30,33)