2-[(2-cyclohexylpyridin-3-yl)methylsulfanyl]pyrimidine

Systemtic Name: 2-[(2-cyclohexylpyridin-3-yl)methylsulfanyl]pyrimidine Openeye Name: 2-[(2-cyclohexyl-3-pyridyl)methylsulfanyl]pyrimidine CAS Name: 2-[(2-cyclohexyl-3-pyridinyl)methylthio]pyrimidine IUPAC Name: 2-[(2-cyclohexylpyridin-3-yl)methylsulfanyl]pyrimidine Traditional Name: 2-[(2-cyclohexyl-3-pyridyl)methylthio]pyrimidine Formula: C16H19N3S MolecularWeight: 285.40716

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C=CC=N2)CSC3=NC=CC=N3

Isomeric SMILES

C1CCC(CC1)C2=C(C=CC=N2)CSC3=NC=CC=N3

InChI

InChI=1S/C16H19N3S/c1-2-6-13(7-3-1)15-14(8-4-9-17-15)12-20-16-18-10-5-11-19-16/h4-5,8-11,13H,1-3,6-7,12H2