1-[6-[(1R)-1-(2-chlorophenyl)ethyl]sulfanylpyridin-3-yl]sulfonyl-4-methyl-piperazine

Systemtic Name: 1-[6-[(1R)-1-(2-chlorophenyl)ethyl]sulfanylpyridin-3-yl]sulfonyl-4-methyl-piperazine Openeye Name: 1-[[6-[(1R)-1-(2-chlorophenyl)ethyl]sulfanyl-3-pyridyl]sulfonyl]-4-methyl-piperazine CAS Name: 1-[[6-[[(1R)-1-(2-chlorophenyl)ethyl]thio]-3-pyridinyl]sulfonyl]-4-methylpiperazine IUPAC Name: 1-[6-[(1R)-1-(2-chlorophenyl)ethyl]sulfanylpyridin-3-yl]sulfonyl-4-methylpiperazine Traditional Name: 1-[[6-[[(1R)-1-(2-chlorophenyl)ethyl]thio]-3-pyridyl]sulfonyl]-4-methyl-piperazine Formula: C18H22ClN3O2S2 MolecularWeight: 411.96918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)SC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1Cl)SC2=NC=C(C=C2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C18H22ClN3O2S2/c1-14(16-5-3-4-6-17(16)19)25-18-8-7-15(13-20-18)26(23,24)22-11-9-21(2)10-12-22/h3-8,13-14H,9-12H2,1-2H3/t14-/m1/s1