4-(methylsulfanylmethyl)-2-phenyl-6-pyrrolidin-1-yl-pyrimidine

Systemtic Name: 4-(methylsulfanylmethyl)-2-phenyl-6-pyrrolidin-1-yl-pyrimidine Openeye Name: 4-(methylsulfanylmethyl)-2-phenyl-6-pyrrolidin-1-yl-pyrimidine CAS Name: 4-[(methylthio)methyl]-2-phenyl-6-(1-pyrrolidinyl)pyrimidine IUPAC Name: 4-(methylsulfanylmethyl)-2-phenyl-6-pyrrolidin-1-ylpyrimidine Traditional Name: 4-[(methylthio)methyl]-2-phenyl-6-pyrrolidino-pyrimidine Formula: C16H19N3S MolecularWeight: 285.40716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC(=NC(=N1)C2=CC=CC=C2)N3CCCC3

Isomeric SMILES

CSCC1=CC(=NC(=N1)C2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C16H19N3S/c1-20-12-14-11-15(19-9-5-6-10-19)18-16(17-14)13-7-3-2-4-8-13/h2-4,7-8,11H,5-6,9-10,12H2,1H3