3-[2-(4-azanylpiperazin-1-yl)-2-oxidanylidene-ethyl]-6-bromanyl-5-chloranyl-1,3-benzothiazol-2-one hydrochloride

Systemtic Name: 3-[2-(4-azanylpiperazin-1-yl)-2-oxidanylidene-ethyl]-6-bromanyl-5-chloranyl-1,3-benzothiazol-2-one hydrochloride Openeye Name: 3-[2-(4-aminopiperazin-1-yl)-2-oxo-ethyl]-6-bromo-5-chloro-1,3-benzothiazol-2-one hydrochloride CAS Name: 3-[2-(4-amino-1-piperazinyl)-2-oxoethyl]-6-bromo-5-chloro-1,3-benzothiazol-2-one hydrochloride IUPAC Name: 3-[2-(4-aminopiperazin-1-yl)-2-oxoethyl]-6-bromo-5-chloro-1,3-benzothiazol-2-one hydrochloride Traditional Name: 3-[2-(4-aminopiperazino)-2-keto-ethyl]-6-bromo-5-chloro-1,3-benzothiazol-2-one hydrochloride Formula: C13H15BrCl2N4O2S MolecularWeight: 442.1588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C3=CC(=C(C=C3SC2=O)Br)Cl)N.Cl

Isomeric SMILES

C1CN(CCN1C(=O)CN2C3=CC(=C(C=C3SC2=O)Br)Cl)N.Cl

InChI

InChI=1S/C13H14BrClN4O2S.ClH/c14-8-5-11-10(6-9(8)15)19(13(21)22-11)7-12(20)17-1-3-18(16)4-2-17;/h5-6H,1-4,7,16H2;1H