2-[1-[6-[(3-cyanophenyl)amino]pyrazin-2-yl]pyrrol-3-yl]ethanoic acid

Systemtic Name: 2-[1-[6-[(3-cyanophenyl)amino]pyrazin-2-yl]pyrrol-3-yl]ethanoic acid Openeye Name: 2-[1-[6-(3-cyanoanilino)pyrazin-2-yl]pyrrol-3-yl]acetic acid CAS Name: 2-[1-[6-(3-cyanoanilino)-2-pyrazinyl]-3-pyrrolyl]acetic acid IUPAC Name: 2-[1-[6-(3-cyanoanilino)pyrazin-2-yl]pyrrol-3-yl]acetic acid Traditional Name: 2-[1-[6-(3-cyanoanilino)pyrazin-2-yl]pyrrol-3-yl]acetic acid Formula: C17H13N5O2 MolecularWeight: 319.31742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC(=CN=C2)N3C=CC(=C3)CC(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC(=CN=C2)N3C=CC(=C3)CC(=O)O)C#N

InChI

InChI=1S/C17H13N5O2/c18-8-12-2-1-3-14(6-12)20-15-9-19-10-16(21-15)22-5-4-13(11-22)7-17(23)24/h1-6,9-11H,7H2,(H,20,21)(H,23,24)