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

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

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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=C3)F)CC4=CC=CO4

Isomeric SMILES

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

InChI

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