2-[(4-fluorophenyl)sulfanylmethyl]-6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)pyrimidin-4-amine

Systemtic Name: 2-[(4-fluorophenyl)sulfanylmethyl]-6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)pyrimidin-4-amine Openeye Name: 2-[(4-fluorophenyl)sulfanylmethyl]-6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)pyrimidin-4-amine CAS Name: 2-[[(4-fluorophenyl)thio]methyl]-6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)-4-pyrimidinamine IUPAC Name: 2-[(4-fluorophenyl)sulfanylmethyl]-6-methyl-N-(5-phenyl-1H-pyrazol-3-yl)pyrimidin-4-amine Traditional Name: [2-[[(4-fluorophenyl)thio]methyl]-6-methyl-pyrimidin-4-yl]-(5-phenyl-1H-pyrazol-3-yl)amine Formula: C21H18FN5S MolecularWeight: 391.464523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)CSC2=CC=C(C=C2)F)NC3=NNC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NC(=N1)CSC2=CC=C(C=C2)F)NC3=NNC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H18FN5S/c1-14-11-19(24-20-12-18(26-27-20)15-5-3-2-4-6-15)25-21(23-14)13-28-17-9-7-16(22)8-10-17/h2-12H,13H2,1H3,(H2,23,24,25,26,27)