1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-2-(2,6-dimethylpyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-2-[(2,6-dimethyl-4-pyrimidinyl)thio]ethanone IUPAC Name: 1-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-2-(2,6-dimethylpyrimidin-4-yl)sulfanylethanone Traditional Name: 1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-2-[(2,6-dimethylpyrimidin-4-yl)thio]ethanone Formula: C16H19ClN4O3S3 MolecularWeight: 446.99506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C)SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CC1=CC(=NC(=N1)C)SCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H19ClN4O3S3/c1-11-9-14(19-12(2)18-11)25-10-15(22)20-5-7-21(8-6-20)27(23,24)16-4-3-13(17)26-16/h3-4,9H,5-8,10H2,1-2H3