2-(3-fluorophenyl)-4-methyl-N-[[3-(methylsulfonylaminomethyl)phenyl]methyl]pyrimidine-5-carboxamide

Systemtic Name: 2-(3-fluorophenyl)-4-methyl-N-[[3-(methylsulfonylaminomethyl)phenyl]methyl]pyrimidine-5-carboxamide Openeye Name: 2-(3-fluorophenyl)-N-[[3-(methanesulfonamidomethyl)phenyl]methyl]-4-methyl-pyrimidine-5-carboxamide CAS Name: 2-(3-fluorophenyl)-N-[[3-(methanesulfonamidomethyl)phenyl]methyl]-4-methyl-5-pyrimidinecarboxamide IUPAC Name: 2-(3-fluorophenyl)-N-[[3-(methanesulfonamidomethyl)phenyl]methyl]-4-methylpyrimidine-5-carboxamide Traditional Name: 2-(3-fluorophenyl)-N-[3-(methanesulfonamidomethyl)benzyl]-4-methyl-pyrimidine-5-carboxamide Formula: C21H21FN4O3S MolecularWeight: 428.479843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NCC2=CC(=CC=C2)CNS(=O)(=O)C)C3=CC(=CC=C3)F

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NCC2=CC(=CC=C2)CNS(=O)(=O)C)C3=CC(=CC=C3)F

InChI

InChI=1S/C21H21FN4O3S/c1-14-19(13-23-20(26-14)17-7-4-8-18(22)10-17)21(27)24-11-15-5-3-6-16(9-15)12-25-30(2,28)29/h3-10,13,25H,11-12H2,1-2H3,(H,24,27)