ethyl 4-azanyl-2-[[2-(4-ethylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[[2-(4-ethylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[[2-(4-ethylphenyl)thiazol-4-yl]methylsulfanyl]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-(4-ethylphenyl)-4-thiazolyl]methylthio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[[2-(4-ethylphenyl)-1,3-thiazol-4-yl]methylsulfanyl]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-(4-ethylphenyl)thiazol-4-yl]methylthio]pyrimidine-5-carboxylic acid ethyl ester Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC=C(C(=N3)N)C(=O)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NC=C(C(=N3)N)C(=O)OCC

InChI

InChI=1S/C19H20N4O2S2/c1-3-12-5-7-13(8-6-12)17-22-14(10-26-17)11-27-19-21-9-15(16(20)23-19)18(24)25-4-2/h5-10H,3-4,11H2,1-2H3,(H2,20,21,23)