ethyl 3-[(3,4-dichlorophenyl)methyl]-5-methyl-4-oxidanylidene-2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 3-[(3,4-dichlorophenyl)methyl]-5-methyl-4-oxidanylidene-2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-[(3,4-dichlorophenyl)methyl]-5-methyl-4-oxo-2-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[(3,4-dichlorophenyl)methyl]-5-methyl-4-oxo-2-[[2-oxo-2-(phenethylamino)ethyl]thio]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(3,4-dichlorophenyl)methyl]-5-methyl-4-oxo-2-[2-oxo-2-(phenethylamino)ethyl]sulfanylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-(3,4-dichlorobenzyl)-4-keto-2-[[2-keto-2-(phenethylamino)ethyl]thio]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C27H25Cl2N3O4S2 MolecularWeight: 590.5411

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3=CC(=C(C=C3)Cl)Cl)SCC(=O)NCCC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(N(C2=O)CC3=CC(=C(C=C3)Cl)Cl)SCC(=O)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C27H25Cl2N3O4S2/c1-3-36-26(35)23-16(2)22-24(38-23)31-27(32(25(22)34)14-18-9-10-19(28)20(29)13-18)37-15-21(33)30-12-11-17-7-5-4-6-8-17/h4-10,13H,3,11-12,14-15H2,1-2H3,(H,30,33)