methyl 4-chloranyl-6-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-(4-oxidanylpiperidin-1-yl)pyrimidine-5-carboxylate

Systemtic Name: methyl 4-chloranyl-6-[(3-chloranyl-4-methoxy-phenyl)methylamino]-2-(4-oxidanylpiperidin-1-yl)pyrimidine-5-carboxylate Openeye Name: methyl 4-chloro-6-[(3-chloro-4-methoxy-phenyl)methylamino]-2-(4-hydroxy-1-piperidyl)pyrimidine-5-carboxylate CAS Name: 4-chloro-6-[(3-chloro-4-methoxyphenyl)methylamino]-2-(4-hydroxy-1-piperidinyl)-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-chloro-6-[(3-chloro-4-methoxyphenyl)methylamino]-2-(4-hydroxypiperidin-1-yl)pyrimidine-5-carboxylate Traditional Name: 4-chloro-6-[(3-chloro-4-methoxy-benzyl)amino]-2-(4-hydroxypiperidino)pyrimidine-5-carboxylic acid methyl ester Formula: C19H22Cl2N4O4 MolecularWeight: 441.30838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=C(C(=NC(=N2)N3CCC(CC3)O)Cl)C(=O)OC)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=C(C(=NC(=N2)N3CCC(CC3)O)Cl)C(=O)OC)Cl

InChI

InChI=1S/C19H22Cl2N4O4/c1-28-14-4-3-11(9-13(14)20)10-22-17-15(18(27)29-2)16(21)23-19(24-17)25-7-5-12(26)6-8-25/h3-4,9,12,26H,5-8,10H2,1-2H3,(H,22,23,24)