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

Systemtic Name: N-(3,4-dimethylphenyl)-5-[(4-fluorophenyl)methyl-(furan-2-ylmethyl)amino]-2-methylsulfonyl-pyrimidine-4-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-5-[(4-fluorophenyl)methyl-(2-furylmethyl)amino]-2-methylsulfonyl-pyrimidine-4-carboxamide CAS Name: N-(3,4-dimethylphenyl)-5-[(4-fluorophenyl)methyl-(2-furanylmethyl)amino]-2-methylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: N-(3,4-dimethylphenyl)-5-[(4-fluorophenyl)methyl-(furan-2-ylmethyl)amino]-2-methylsulfonylpyrimidine-4-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-5-[(4-fluorobenzyl)-(2-furfuryl)amino]-2-mesyl-pyrimidine-4-carboxamide Formula: C26H25FN4O4S MolecularWeight: 508.564503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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