methyl 3-[[2-(2-chloranyl-4-methoxy-phenyl)-1,4-dimethyl-6-oxidanylidene-pyrimidin-5-yl]amino]-4-ethoxy-pyrrolidine-1-carboxylate

Systemtic Name: methyl 3-[[2-(2-chloranyl-4-methoxy-phenyl)-1,4-dimethyl-6-oxidanylidene-pyrimidin-5-yl]amino]-4-ethoxy-pyrrolidine-1-carboxylate Openeye Name: methyl 3-[[2-(2-chloro-4-methoxy-phenyl)-1,4-dimethyl-6-oxo-pyrimidin-5-yl]amino]-4-ethoxy-pyrrolidine-1-carboxylate CAS Name: 3-[[2-(2-chloro-4-methoxyphenyl)-1,4-dimethyl-6-oxo-5-pyrimidinyl]amino]-4-ethoxy-1-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(2-chloro-4-methoxyphenyl)-1,4-dimethyl-6-oxopyrimidin-5-yl]amino]-4-ethoxypyrrolidine-1-carboxylate Traditional Name: 3-[[2-(2-chloro-4-methoxy-phenyl)-6-keto-1,4-dimethyl-pyrimidin-5-yl]amino]-4-ethoxy-pyrrolidine-1-carboxylic acid methyl ester Formula: C21H27ClN4O5 MolecularWeight: 450.91588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1CN(CC1NC2=C(N=C(N(C2=O)C)C3=C(C=C(C=C3)OC)Cl)C)C(=O)OC

Isomeric SMILES

CCOC1CN(CC1NC2=C(N=C(N(C2=O)C)C3=C(C=C(C=C3)OC)Cl)C)C(=O)OC

InChI

InChI=1S/C21H27ClN4O5/c1-6-31-17-11-26(21(28)30-5)10-16(17)24-18-12(2)23-19(25(3)20(18)27)14-8-7-13(29-4)9-15(14)22/h7-9,16-17,24H,6,10-11H2,1-5H3