2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-(4-methylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-(4-mesylpiperazino)ethanone Formula: C14H16ClN3O3S3 MolecularWeight: 405.94314

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C14H16ClN3O3S3/c1-24(20,21)18-6-4-17(5-7-18)13(19)9-22-14-16-11-8-10(15)2-3-12(11)23-14/h2-3,8H,4-7,9H2,1H3