3-(1,3-benzothiazol-2-ylcarbamoyl)pyrazine-2-carboxylic acid

Systemtic Name: 3-(1,3-benzothiazol-2-ylcarbamoyl)pyrazine-2-carboxylic acid Openeye Name: 3-(1,3-benzothiazol-2-ylcarbamoyl)pyrazine-2-carboxylic acid CAS Name: 3-[(1,3-benzothiazol-2-ylamino)-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-(1,3-benzothiazol-2-ylcarbamoyl)pyrazine-2-carboxylic acid Traditional Name: 3-(1,3-benzothiazol-2-ylcarbamoyl)pyrazinoic acid Formula: C13H8N4O3S MolecularWeight: 300.29262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=NC=CN=C3C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=NC=CN=C3C(=O)O

InChI

InChI=1S/C13H8N4O3S/c18-11(9-10(12(19)20)15-6-5-14-9)17-13-16-7-3-1-2-4-8(7)21-13/h1-6H,(H,19,20)(H,16,17,18)