2-phenyl-4-(pyrimidin-4-ylmethylsulfanyl)butan-2-ol

Systemtic Name: 2-phenyl-4-(pyrimidin-4-ylmethylsulfanyl)butan-2-ol Openeye Name: 2-phenyl-4-(pyrimidin-4-ylmethylsulfanyl)butan-2-ol CAS Name: 2-phenyl-4-(4-pyrimidinylmethylthio)-2-butanol IUPAC Name: 2-phenyl-4-(pyrimidin-4-ylmethylsulfanyl)butan-2-ol Traditional Name: 2-phenyl-4-(4-pyrimidylmethylthio)butan-2-ol Formula: C15H18N2OS MolecularWeight: 274.38122

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCSCC1=NC=NC=C1)(C2=CC=CC=C2)O

Isomeric SMILES

CC(CCSCC1=NC=NC=C1)(C2=CC=CC=C2)O

InChI

InChI=1S/C15H18N2OS/c1-15(18,13-5-3-2-4-6-13)8-10-19-11-14-7-9-16-12-17-14/h2-7,9,12,18H,8,10-11H2,1H3