3-[2-(4-azanylpiperazin-1-yl)-2-oxidanylidene-ethyl]-5-chloranyl-1,3-benzothiazol-2-one hydrochloride

Systemtic Name: 3-[2-(4-azanylpiperazin-1-yl)-2-oxidanylidene-ethyl]-5-chloranyl-1,3-benzothiazol-2-one hydrochloride Openeye Name: 3-[2-(4-aminopiperazin-1-yl)-2-oxo-ethyl]-5-chloro-1,3-benzothiazol-2-one hydrochloride CAS Name: 3-[2-(4-amino-1-piperazinyl)-2-oxoethyl]-5-chloro-1,3-benzothiazol-2-one hydrochloride IUPAC Name: 3-[2-(4-aminopiperazin-1-yl)-2-oxoethyl]-5-chloro-1,3-benzothiazol-2-one hydrochloride Traditional Name: 3-[2-(4-aminopiperazino)-2-keto-ethyl]-5-chloro-1,3-benzothiazol-2-one hydrochloride Formula: C13H16Cl2N4O2S MolecularWeight: 363.26274

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O)N.Cl

Isomeric SMILES

C1CN(CCN1C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O)N.Cl

InChI

InChI=1S/C13H15ClN4O2S.ClH/c14-9-1-2-11-10(7-9)18(13(20)21-11)8-12(19)16-3-5-17(15)6-4-16;/h1-2,7H,3-6,8,15H2;1H