4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-4-oxo-butanoate CAS Name: 4-[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-4-oxobutanoate IUPAC Name: 4-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-4-oxobutanoate Traditional Name: 4-[4-(1,3-benzothiazol-2-yl)piperazino]-4-keto-butyrate Formula: C15H16N3O3S- MolecularWeight: 318.37084

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)CCC(=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C15H17N3O3S/c19-13(5-6-14(20)21)17-7-9-18(10-8-17)15-16-11-3-1-2-4-12(11)22-15/h1-4H,5-10H2,(H,20,21)/p-1