4-[5-azanyl-6-(pyridin-3-ylcarbamoyl)pyrazin-2-yl]benzoic acid

Systemtic Name: 4-[5-azanyl-6-(pyridin-3-ylcarbamoyl)pyrazin-2-yl]benzoic acid Openeye Name: 4-[5-amino-6-(3-pyridylcarbamoyl)pyrazin-2-yl]benzoic acid CAS Name: 4-[5-amino-6-[oxo-(3-pyridinylamino)methyl]-2-pyrazinyl]benzoic acid IUPAC Name: 4-[5-amino-6-(pyridin-3-ylcarbamoyl)pyrazin-2-yl]benzoic acid Traditional Name: 4-[5-amino-6-(3-pyridylcarbamoyl)pyrazin-2-yl]benzoic acid Formula: C17H13N5O3 MolecularWeight: 335.31682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC(=O)C2=NC(=CN=C2N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)NC(=O)C2=NC(=CN=C2N)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C17H13N5O3/c18-15-14(16(23)21-12-2-1-7-19-8-12)22-13(9-20-15)10-3-5-11(6-4-10)17(24)25/h1-9H,(H2,18,20)(H,21,23)(H,24,25)