4-[(2-chlorophenyl)methylsulfanyl]-6-piperidin-1-yl-pyrimidine

Systemtic Name: 4-[(2-chlorophenyl)methylsulfanyl]-6-piperidin-1-yl-pyrimidine Openeye Name: 4-[(2-chlorophenyl)methylsulfanyl]-6-(1-piperidyl)pyrimidine CAS Name: 4-[(2-chlorophenyl)methylthio]-6-(1-piperidinyl)pyrimidine IUPAC Name: 4-[(2-chlorophenyl)methylsulfanyl]-6-piperidin-1-ylpyrimidine Traditional Name: 4-[(2-chlorobenzyl)thio]-6-piperidino-pyrimidine Formula: C16H18ClN3S MolecularWeight: 319.85222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC=N2)SCC3=CC=CC=C3Cl

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC=N2)SCC3=CC=CC=C3Cl

InChI

InChI=1S/C16H18ClN3S/c17-14-7-3-2-6-13(14)11-21-16-10-15(18-12-19-16)20-8-4-1-5-9-20/h2-3,6-7,10,12H,1,4-5,8-9,11H2