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2-[[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylamino]benzoic acid

2-[[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylamino]benzoic acid

Systemtic Name:2-[[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylamino]benzoic acid
Openeye Name:2-[[4-(1,3-benzothiazol-2-yl)piperazine-1-carbonyl]amino]benzoic acid
CAS Name:2-[[[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]amino]benzoic acid
IUPAC Name:2-[[4-(1,3-benzothiazol-2-yl)piperazine-1-carbonyl]amino]benzoic acid
Traditional Name:2-[[4-(1,3-benzothiazol-2-yl)piperazine-1-carbonyl]amino]benzoic acid
Formula: C19H18N4O3S
MolecularWeight: 382.43622
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)NC4=CC=CC=C4C(=O)O


Isomeric SMILES

C1CN(CCN1C2=NC3=CC=CC=C3S2)C(=O)NC4=CC=CC=C4C(=O)O


InChI

InChI=1S/C19H18N4O3S/c24-17(25)13-5-1-2-6-14(13)20-18(26)22-9-11-23(12-10-22)19-21-15-7-3-4-8-16(15)27-19/h1-8H,9-12H2,(H,20,26)(H,24,25)


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