2-[(2-methylphenyl)methylsulfanyl]-5-piperidin-1-ylsulfonyl-pyridine

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-5-piperidin-1-ylsulfonyl-pyridine Openeye Name: 2-(o-tolylmethylsulfanyl)-5-(1-piperidylsulfonyl)pyridine CAS Name: 2-[(2-methylphenyl)methylthio]-5-(1-piperidinylsulfonyl)pyridine IUPAC Name: 2-[(2-methylphenyl)methylsulfanyl]-5-piperidin-1-ylsulfonylpyridine Traditional Name: 2-[(2-methylbenzyl)thio]-5-piperidinosulfonyl-pyridine Formula: C18H22N2O2S2 MolecularWeight: 362.50948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H22N2O2S2/c1-15-7-3-4-8-16(15)14-23-18-10-9-17(13-19-18)24(21,22)20-11-5-2-6-12-20/h3-4,7-10,13H,2,5-6,11-12,14H2,1H3