2-ethylsulfonyl-5-[(2-fluorophenyl)methyl-(furan-2-ylmethyl)amino]-N-(3-methylphenyl)pyrimidine-4-carboxamide

Systemtic Name: 2-ethylsulfonyl-5-[(2-fluorophenyl)methyl-(furan-2-ylmethyl)amino]-N-(3-methylphenyl)pyrimidine-4-carboxamide Openeye Name: 2-ethylsulfonyl-5-[(2-fluorophenyl)methyl-(2-furylmethyl)amino]-N-(m-tolyl)pyrimidine-4-carboxamide CAS Name: 2-ethylsulfonyl-5-[(2-fluorophenyl)methyl-(2-furanylmethyl)amino]-N-(3-methylphenyl)-4-pyrimidinecarboxamide IUPAC Name: 2-ethylsulfonyl-5-[(2-fluorophenyl)methyl-(furan-2-ylmethyl)amino]-N-(3-methylphenyl)pyrimidine-4-carboxamide Traditional Name: 2-esyl-5-[(2-fluorobenzyl)-(2-furfuryl)amino]-N-(m-tolyl)pyrimidine-4-carboxamide Formula: C26H25FN4O4S MolecularWeight: 508.564503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=CC=CC(=C2)C)N(CC3=CC=CC=C3F)CC4=CC=CO4

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=CC=CC(=C2)C)N(CC3=CC=CC=C3F)CC4=CC=CO4

InChI

InChI=1S/C26H25FN4O4S/c1-3-36(33,34)26-28-15-23(24(30-26)25(32)29-20-10-6-8-18(2)14-20)31(17-21-11-7-13-35-21)16-19-9-4-5-12-22(19)27/h4-15H,3,16-17H2,1-2H3,(H,29,32)