methyl 4-[3-(4-methoxyphenoxy)propylsulfanyl]-6-methyl-2-propan-2-yl-pyrimidine-5-carboxylate

Systemtic Name: methyl 4-[3-(4-methoxyphenoxy)propylsulfanyl]-6-methyl-2-propan-2-yl-pyrimidine-5-carboxylate Openeye Name: methyl 2-isopropyl-4-[3-(4-methoxyphenoxy)propylsulfanyl]-6-methyl-pyrimidine-5-carboxylate CAS Name: 4-[3-(4-methoxyphenoxy)propylthio]-6-methyl-2-propan-2-yl-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[3-(4-methoxyphenoxy)propylsulfanyl]-6-methyl-2-propan-2-ylpyrimidine-5-carboxylate Traditional Name: 2-isopropyl-4-[3-(4-methoxyphenoxy)propylthio]-6-methyl-pyrimidine-5-carboxylic acid methyl ester Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C(C)C)SCCCOC2=CC=C(C=C2)OC)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)C(C)C)SCCCOC2=CC=C(C=C2)OC)C(=O)OC

InChI

InChI=1S/C20H26N2O4S/c1-13(2)18-21-14(3)17(20(23)25-5)19(22-18)27-12-6-11-26-16-9-7-15(24-4)8-10-16/h7-10,13H,6,11-12H2,1-5H3