2-[(3-chlorophenyl)amino]-2-(pyridin-2-ylamino)-2-pyrimidin-4-yl-ethanoic acid

Systemtic Name: 2-[(3-chlorophenyl)amino]-2-(pyridin-2-ylamino)-2-pyrimidin-4-yl-ethanoic acid Openeye Name: 2-(3-chloroanilino)-2-(2-pyridylamino)-2-pyrimidin-4-yl-acetic acid CAS Name: 2-(3-chloroanilino)-2-(2-pyridinylamino)-2-(4-pyrimidinyl)acetic acid IUPAC Name: 2-(3-chloroanilino)-2-(pyridin-2-ylamino)-2-pyrimidin-4-ylacetic acid Traditional Name: 2-(3-chloroanilino)-2-(2-pyridylamino)-2-(4-pyrimidyl)acetic acid Formula: C17H14ClN5O2 MolecularWeight: 355.77836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NC(C2=NC=NC=C2)(C(=O)O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

C1=CC=NC(=C1)NC(C2=NC=NC=C2)(C(=O)O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H14ClN5O2/c18-12-4-3-5-13(10-12)22-17(16(24)25,14-7-9-19-11-21-14)23-15-6-1-2-8-20-15/h1-11,22H,(H,20,23)(H,24,25)