N-(3-chloranyl-4-methyl-phenyl)-5-[(3-fluorophenyl)methyl-(furan-2-ylmethyl)amino]-2-methylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-5-[(3-fluorophenyl)methyl-(furan-2-ylmethyl)amino]-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-5-[(3-fluorophenyl)methyl-(2-furylmethyl)amino]-2-methylsulfonyl-pyrimidine-4-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-5-[(3-fluorophenyl)methyl-(2-furanylmethyl)amino]-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-5-[(3-fluorophenyl)methyl-(furan-2-ylmethyl)amino]-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-5-[(3-fluorobenzyl)-(2-furfuryl)amino]-2-mesyl-pyrimidine-4-carboxamide Formula: C25H22ClFN4O4S MolecularWeight: 528.982983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NC(=NC=C2N(CC3=CC(=CC=C3)F)CC4=CC=CO4)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NC(=NC=C2N(CC3=CC(=CC=C3)F)CC4=CC=CO4)S(=O)(=O)C)Cl

InChI

InChI=1S/C25H22ClFN4O4S/c1-16-8-9-19(12-21(16)26)29-24(32)23-22(13-28-25(30-23)36(2,33)34)31(15-20-7-4-10-35-20)14-17-5-3-6-18(27)11-17/h3-13H,14-15H2,1-2H3,(H,29,32)