3-pyrrol-1-yl-2H-1,3-benzothiazole-2-carboxylic acid

Systemtic Name: 3-pyrrol-1-yl-2H-1,3-benzothiazole-2-carboxylic acid Openeye Name: 3-pyrrol-1-yl-2H-1,3-benzothiazole-2-carboxylic acid CAS Name: 3-(1-pyrrolyl)-2H-1,3-benzothiazole-2-carboxylic acid IUPAC Name: 3-pyrrol-1-yl-2H-1,3-benzothiazole-2-carboxylic acid Traditional Name: 3-pyrrol-1-yl-2H-1,3-benzothiazole-2-carboxylic acid Formula: C12H10N2O2S MolecularWeight: 246.285

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(S2)C(=O)O)N3C=CC=C3

Isomeric SMILES

C1=CC=C2C(=C1)N(C(S2)C(=O)O)N3C=CC=C3

InChI

InChI=1S/C12H10N2O2S/c15-12(16)11-14(13-7-3-4-8-13)9-5-1-2-6-10(9)17-11/h1-8,11H,(H,15,16)