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

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-1-[4-(phenylsulfonyl)piperazin-1-yl]ethanone Openeye Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]ethanone CAS Name: 1-[4-(benzenesulfonyl)-1-piperazinyl]-2-[(5-chloro-1,3-benzothiazol-2-yl)thio]ethanone IUPAC Name: 1-[4-(benzenesulfonyl)piperazin-1-yl]-2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(4-besylpiperazino)-2-[(5-chloro-1,3-benzothiazol-2-yl)thio]ethanone Formula: C19H18ClN3O3S3 MolecularWeight: 468.01252

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H18ClN3O3S3/c20-14-6-7-17-16(12-14)21-19(28-17)27-13-18(24)22-8-10-23(11-9-22)29(25,26)15-4-2-1-3-5-15/h1-7,12H,8-11,13H2