ethyl 4-(4-methoxyphenyl)-6-methyl-1,3-bis(morpholin-4-ylmethyl)-2-sulfanylidene-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-6-methyl-1,3-bis(morpholin-4-ylmethyl)-2-sulfanylidene-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-6-methyl-1,3-bis(morpholinomethyl)-2-thioxo-4H-pyrimidine-5-carboxylate CAS Name: 4-(4-methoxyphenyl)-6-methyl-1,3-bis(4-morpholinylmethyl)-2-sulfanylidene-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-6-methyl-1,3-bis(morpholin-4-ylmethyl)-2-sulfanylidene-4H-pyrimidine-5-carboxylate Traditional Name: 4-(4-methoxyphenyl)-6-methyl-1,3-bis(morpholinomethyl)-2-thioxo-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C25H36N4O5S MolecularWeight: 504.64214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)N(C1C2=CC=C(C=C2)OC)CN3CCOCC3)CN4CCOCC4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N(C1C2=CC=C(C=C2)OC)CN3CCOCC3)CN4CCOCC4)C

InChI

InChI=1S/C25H36N4O5S/c1-4-34-24(30)22-19(2)28(17-26-9-13-32-14-10-26)25(35)29(18-27-11-15-33-16-12-27)23(22)20-5-7-21(31-3)8-6-20/h5-8,23H,4,9-18H2,1-3H3