2-hexylsulfanyl-4-methyl-6-(pyrrolidin-1-ylmethyl)pyrimidine

Systemtic Name: 2-hexylsulfanyl-4-methyl-6-(pyrrolidin-1-ylmethyl)pyrimidine Openeye Name: 2-hexylsulfanyl-4-methyl-6-(pyrrolidin-1-ylmethyl)pyrimidine CAS Name: 2-(hexylthio)-4-methyl-6-(1-pyrrolidinylmethyl)pyrimidine IUPAC Name: 2-hexylsulfanyl-4-methyl-6-(pyrrolidin-1-ylmethyl)pyrimidine Traditional Name: 2-(hexylthio)-4-methyl-6-(pyrrolidinomethyl)pyrimidine Formula: C16H27N3S MolecularWeight: 293.47068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC(=CC(=N1)CN2CCCC2)C

Isomeric SMILES

CCCCCCSC1=NC(=CC(=N1)CN2CCCC2)C

InChI

InChI=1S/C16H27N3S/c1-3-4-5-8-11-20-16-17-14(2)12-15(18-16)13-19-9-6-7-10-19/h12H,3-11,13H2,1-2H3