2-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]ethanone CAS Name: 2-(1,3-benzothiazol-2-ylthio)-1-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]ethanone IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-1-[4-[(5-methyl-2-thienyl)sulfonyl]piperazino]ethanone Formula: C18H19N3O3S4 MolecularWeight: 453.62176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H19N3O3S4/c1-13-6-7-17(26-13)28(23,24)21-10-8-20(9-11-21)16(22)12-25-18-19-14-4-2-3-5-15(14)27-18/h2-7H,8-12H2,1H3