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

Systemtic Name: 3-[2-(4-azanylpiperazin-1-yl)-2-oxidanylidene-ethyl]-1,3-benzothiazol-2-one Openeye Name: 3-[2-(4-aminopiperazin-1-yl)-2-oxo-ethyl]-1,3-benzothiazol-2-one CAS Name: 3-[2-(4-amino-1-piperazinyl)-2-oxoethyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[2-(4-aminopiperazin-1-yl)-2-oxoethyl]-1,3-benzothiazol-2-one Traditional Name: 3-[2-(4-aminopiperazino)-2-keto-ethyl]-1,3-benzothiazol-2-one Formula: C13H16N4O2S MolecularWeight: 292.35674

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C3=CC=CC=C3SC2=O)N

Isomeric SMILES

C1CN(CCN1C(=O)CN2C3=CC=CC=C3SC2=O)N

InChI

InChI=1S/C13H16N4O2S/c14-16-7-5-15(6-8-16)12(18)9-17-10-3-1-2-4-11(10)20-13(17)19/h1-4H,5-9,14H2