2-methylsulfanyl-4-[3-[1-[[(2R)-oxolan-2-yl]methyl]pyrazol-3-yl]phenyl]pyrimidine

Systemtic Name: 2-methylsulfanyl-4-[3-[1-[[(2R)-oxolan-2-yl]methyl]pyrazol-3-yl]phenyl]pyrimidine Openeye Name: 2-methylsulfanyl-4-[3-[1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrazol-3-yl]phenyl]pyrimidine CAS Name: 2-(methylthio)-4-[3-[1-[[(2R)-2-oxolanyl]methyl]-3-pyrazolyl]phenyl]pyrimidine IUPAC Name: 2-methylsulfanyl-4-[3-[1-[[(2R)-oxolan-2-yl]methyl]pyrazol-3-yl]phenyl]pyrimidine Traditional Name: 2-(methylthio)-4-[3-[1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrazol-3-yl]phenyl]pyrimidine Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)C2=CC(=CC=C2)C3=NN(C=C3)CC4CCCO4

Isomeric SMILES

CSC1=NC=CC(=N1)C2=CC(=CC=C2)C3=NN(C=C3)C[C@H]4CCCO4

InChI

InChI=1S/C19H20N4OS/c1-25-19-20-9-7-17(21-19)14-4-2-5-15(12-14)18-8-10-23(22-18)13-16-6-3-11-24-16/h2,4-5,7-10,12,16H,3,6,11,13H2,1H3/t16-/m1/s1