oxidanylidene-[4-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-1,3-thiazol-4-yl]phenyl]azanium chloride

Systemtic Name: oxidanylidene-[4-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-1,3-thiazol-4-yl]phenyl]azanium chloride Openeye Name: oxo-[4-[2-[4-(2-thienylsulfonyl)piperazin-1-yl]thiazol-4-yl]phenyl]ammonium chloride CAS Name: oxo-[4-[2-(4-thiophen-2-ylsulfonyl-1-piperazinyl)-4-thiazolyl]phenyl]ammonium chloride IUPAC Name: oxo-[4-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)-1,3-thiazol-4-yl]phenyl]azanium chloride Traditional Name: keto-[4-[2-[4-(2-thienylsulfonyl)piperazino]thiazol-4-yl]phenyl]ammonium chloride Formula: C17H17ClN4O3S3 MolecularWeight: 456.98988

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=CS2)C3=CC=C(C=C3)[NH+]=O)S(=O)(=O)C4=CC=CS4.[Cl-]

Isomeric SMILES

C1CN(CCN1C2=NC(=CS2)C3=CC=C(C=C3)[NH+]=O)S(=O)(=O)C4=CC=CS4.[Cl-]

InChI

InChI=1S/C17H16N4O3S3.ClH/c22-19-14-5-3-13(4-6-14)15-12-26-17(18-15)20-7-9-21(10-8-20)27(23,24)16-2-1-11-25-16;/h1-6,11-12H,7-10H2;1H