2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)pyridine-3-carboxylic acid

Systemtic Name: 2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)pyridine-3-carboxylic acid Openeye Name: 2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)pyridine-3-carboxylic acid CAS Name: 2-[oxo-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylamino)methyl]-3-pyridinecarboxylic acid IUPAC Name: 2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)pyridine-3-carboxylic acid Traditional Name: 2-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-ylcarbamoyl)nicotinic acid Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)C3=C(C=CC=N3)C(=O)O

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)C3=C(C=CC=N3)C(=O)O

InChI

InChI=1S/C14H13N3O3S/c18-12(11-8(13(19)20)4-3-7-15-11)17-14-16-9-5-1-2-6-10(9)21-14/h3-4,7H,1-2,5-6H2,(H,19,20)(H,16,17,18)