2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propanoic acid

Systemtic Name: 2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propanoic acid Openeye Name: 2-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]sulfanylpropanoic acid CAS Name: 2-[[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]thio]propanoic acid IUPAC Name: 2-[[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]sulfanyl]propanoic acid Traditional Name: 2-[[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]thio]propionic acid Formula: C13H10N2O2S3 MolecularWeight: 322.4257

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC(=CS1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C(=O)O)SC1=NC(=CS1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H10N2O2S3/c1-7(12(16)17)19-13-15-9(6-18-13)11-14-8-4-2-3-5-10(8)20-11/h2-7H,1H3,(H,16,17)