2-[4-[[5-ethyl-6-methyl-2-(5-methylthiophen-2-yl)pyrimidin-4-yl]amino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[[5-ethyl-6-methyl-2-(5-methylthiophen-2-yl)pyrimidin-4-yl]amino]phenyl]ethanoic acid Openeye Name: 2-[4-[[5-ethyl-6-methyl-2-(5-methyl-2-thienyl)pyrimidin-4-yl]amino]phenyl]acetic acid CAS Name: 2-[4-[[5-ethyl-6-methyl-2-(5-methyl-2-thiophenyl)-4-pyrimidinyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[[5-ethyl-6-methyl-2-(5-methylthiophen-2-yl)pyrimidin-4-yl]amino]phenyl]acetic acid Traditional Name: 2-[4-[[5-ethyl-6-methyl-2-(5-methyl-2-thienyl)pyrimidin-4-yl]amino]phenyl]acetic acid Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1NC2=CC=C(C=C2)CC(=O)O)C3=CC=C(S3)C)C

Isomeric SMILES

CCC1=C(N=C(N=C1NC2=CC=C(C=C2)CC(=O)O)C3=CC=C(S3)C)C

InChI

InChI=1S/C20H21N3O2S/c1-4-16-13(3)21-20(17-10-5-12(2)26-17)23-19(16)22-15-8-6-14(7-9-15)11-18(24)25/h5-10H,4,11H2,1-3H3,(H,24,25)(H,21,22,23)