3-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]propanoate

Systemtic Name: 3-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]propanoate Openeye Name: 3-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-4-(4-methoxyphenyl)thiazol-5-yl]propanoate CAS Name: 3-[2-[(4,6-dimethyl-2-pyrimidinyl)amino]-4-(4-methoxyphenyl)-5-thiazolyl]propanoate IUPAC Name: 3-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-4-(4-methoxyphenyl)-1,3-thiazol-5-yl]propanoate Traditional Name: 3-[2-[(4,6-dimethylpyrimidin-2-yl)amino]-4-(4-methoxyphenyl)thiazol-5-yl]propionate Formula: C19H19N4O3S- MolecularWeight: 383.44416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=NC(=C(S2)CCC(=O)[O-])C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=NC(=C(S2)CCC(=O)[O-])C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C19H20N4O3S/c1-11-10-12(2)21-18(20-11)23-19-22-17(15(27-19)8-9-16(24)25)13-4-6-14(26-3)7-5-13/h4-7,10H,8-9H2,1-3H3,(H,24,25)(H,20,21,22,23)/p-1