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2-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methylamino]benzoic acid

2-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methylamino]benzoic acid

Systemtic Name:2-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methylamino]benzoic acid
Openeye Name:2-[(2-thioxo-1,3-benzothiazol-3-yl)methylamino]benzoic acid
CAS Name:2-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methylamino]benzoic acid
IUPAC Name:2-[(2-sulfanylidene-1,3-benzothiazol-3-yl)methylamino]benzoic acid
Traditional Name:2-[(2-thioxo-1,3-benzothiazol-3-yl)methylamino]benzoic acid
Formula: C15H12N2O2S2
MolecularWeight: 316.39798
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NCN2C3=CC=CC=C3SC2=S


Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NCN2C3=CC=CC=C3SC2=S


InChI

InChI=1S/C15H12N2O2S2/c18-14(19)10-5-1-2-6-11(10)16-9-17-12-7-3-4-8-13(12)21-15(17)20/h1-8,16H,9H2,(H,18,19)


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