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

Systemtic Name: 2-(3-fluorophenyl)-4-methyl-N-[[3-[(propan-2-ylsulfonylamino)methyl]phenyl]methyl]pyrimidine-5-carboxamide Openeye Name: 2-(3-fluorophenyl)-N-[[3-[(isopropylsulfonylamino)methyl]phenyl]methyl]-4-methyl-pyrimidine-5-carboxamide CAS Name: 2-(3-fluorophenyl)-4-methyl-N-[[3-[(propan-2-ylsulfonylamino)methyl]phenyl]methyl]-5-pyrimidinecarboxamide IUPAC Name: 2-(3-fluorophenyl)-4-methyl-N-[[3-[(propan-2-ylsulfonylamino)methyl]phenyl]methyl]pyrimidine-5-carboxamide Traditional Name: 2-(3-fluorophenyl)-N-[3-[(isopropylsulfonylamino)methyl]benzyl]-4-methyl-pyrimidine-5-carboxamide Formula: C23H25FN4O3S MolecularWeight: 456.533003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25FN4O3S/c1-15(2)32(30,31)27-13-18-7-4-6-17(10-18)12-26-23(29)21-14-25-22(28-16(21)3)19-8-5-9-20(24)11-19/h4-11,14-15,27H,12-13H2,1-3H3,(H,26,29)