1-methyl-4-[6-[(4-methylphenyl)methylsulfanyl]pyridin-3-yl]sulfonyl-piperazine

Systemtic Name: 1-methyl-4-[6-[(4-methylphenyl)methylsulfanyl]pyridin-3-yl]sulfonyl-piperazine Openeye Name: 1-methyl-4-[[6-(p-tolylmethylsulfanyl)-3-pyridyl]sulfonyl]piperazine CAS Name: 1-methyl-4-[[6-[(4-methylphenyl)methylthio]-3-pyridinyl]sulfonyl]piperazine IUPAC Name: 1-methyl-4-[6-[(4-methylphenyl)methylsulfanyl]pyridin-3-yl]sulfonylpiperazine Traditional Name: 1-methyl-4-[[6-[(4-methylbenzyl)thio]-3-pyridyl]sulfonyl]piperazine Formula: C18H23N3O2S2 MolecularWeight: 377.52412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C18H23N3O2S2/c1-15-3-5-16(6-4-15)14-24-18-8-7-17(13-19-18)25(22,23)21-11-9-20(2)10-12-21/h3-8,13H,9-12,14H2,1-2H3