1-oxidanylidene-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one hydrochloride

Systemtic Name: 1-oxidanylidene-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one hydrochloride Openeye Name: 1-oxo-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one hydrochloride CAS Name: 1-oxo-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-1,2-benzothiazol-3-one hydrochloride IUPAC Name: 1-oxo-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]-1,2-benzothiazol-3-one hydrochloride Traditional Name: 1-keto-2-[4-[4-(2-pyrimidyl)piperazino]butyl]-1,2-benzothiazol-3-one hydrochloride Formula: C19H24ClN5O2S MolecularWeight: 421.94416

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3S2=O)C4=NC=CC=N4.Cl

Isomeric SMILES

C1CN(CCN1CCCCN2C(=O)C3=CC=CC=C3S2=O)C4=NC=CC=N4.Cl

InChI

InChI=1S/C19H23N5O2S.ClH/c25-18-16-6-1-2-7-17(16)27(26)24(18)11-4-3-10-22-12-14-23(15-13-22)19-20-8-5-9-21-19;/h1-2,5-9H,3-4,10-15H2;1H