ethyl 6-(2-methoxycarbonylphenyl)-4-methyl-2-oxidanylidene-3-(thiophen-2-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(2-methoxycarbonylphenyl)-4-methyl-2-oxidanylidene-3-(thiophen-2-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(2-methoxycarbonylphenyl)-4-methyl-2-oxo-3-(2-thienylmethyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(2-methoxycarbonylphenyl)-4-methyl-2-oxo-3-(thiophen-2-ylmethyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(2-methoxycarbonylphenyl)-4-methyl-2-oxo-3-(thiophen-2-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(2-carbomethoxyphenyl)-2-keto-4-methyl-3-(2-thenyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2C(=O)OC)CC3=CC=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2C(=O)OC)CC3=CC=CS3)C

InChI

InChI=1S/C21H22N2O5S/c1-4-28-20(25)17-13(2)23(12-14-8-7-11-29-14)21(26)22-18(17)15-9-5-6-10-16(15)19(24)27-3/h5-11,18H,4,12H2,1-3H3,(H,22,26)