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

Systemtic Name: 2-[1-[6-[(3-methylphenyl)amino]pyrazin-2-yl]pyrrol-3-yl]ethanoic acid Openeye Name: 2-[1-[6-(3-methylanilino)pyrazin-2-yl]pyrrol-3-yl]acetic acid CAS Name: 2-[1-[6-(3-methylanilino)-2-pyrazinyl]-3-pyrrolyl]acetic acid IUPAC Name: 2-[1-[6-(3-methylanilino)pyrazin-2-yl]pyrrol-3-yl]acetic acid Traditional Name: 2-[1-[6-(m-toluidino)pyrazin-2-yl]pyrrol-3-yl]acetic acid Formula: C17H16N4O2 MolecularWeight: 308.33454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=CN=C2)N3C=CC(=C3)CC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=CN=C2)N3C=CC(=C3)CC(=O)O

InChI

InChI=1S/C17H16N4O2/c1-12-3-2-4-14(7-12)19-15-9-18-10-16(20-15)21-6-5-13(11-21)8-17(22)23/h2-7,9-11H,8H2,1H3,(H,19,20)(H,22,23)