1-[6-(2-chloranylprop-2-enylsulfanyl)pyridin-3-yl]sulfonyl-4-(phenylmethyl)piperazine

Systemtic Name: 1-[6-(2-chloranylprop-2-enylsulfanyl)pyridin-3-yl]sulfonyl-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-[[6-(2-chloroallylsulfanyl)-3-pyridyl]sulfonyl]piperazine CAS Name: 1-[[6-(2-chloroprop-2-enylthio)-3-pyridinyl]sulfonyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-[6-(2-chloroprop-2-enylsulfanyl)pyridin-3-yl]sulfonylpiperazine Traditional Name: 1-benzyl-4-[[6-(2-chloroallylthio)-3-pyridyl]sulfonyl]piperazine Formula: C19H22ClN3O2S2 MolecularWeight: 423.97988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(CSC1=NC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)Cl

Isomeric SMILES

C=C(CSC1=NC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C19H22ClN3O2S2/c1-16(20)15-26-19-8-7-18(13-21-19)27(24,25)23-11-9-22(10-12-23)14-17-5-3-2-4-6-17/h2-8,13H,1,9-12,14-15H2