2-phenoxyethyl 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-phenoxyethyl 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-phenoxyethyl 5-methyl-4-oxo-3-[2-oxo-2-(2-phenylsulfanylanilino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[2-oxo-2-[2-(phenylthio)anilino]ethyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 5-methyl-4-oxo-3-[2-oxo-2-(2-phenylsulfanylanilino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-[2-keto-2-[2-(phenylthio)anilino]ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid 2-phenoxyethyl ester Formula: C30H25N3O5S2 MolecularWeight: 571.6666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)NC3=CC=CC=C3SC4=CC=CC=C4)C(=O)OCCOC5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)NC3=CC=CC=C3SC4=CC=CC=C4)C(=O)OCCOC5=CC=CC=C5

InChI

InChI=1S/C30H25N3O5S2/c1-20-26-28(40-27(20)30(36)38-17-16-37-21-10-4-2-5-11-21)31-19-33(29(26)35)18-25(34)32-23-14-8-9-15-24(23)39-22-12-6-3-7-13-22/h2-15,19H,16-18H2,1H3,(H,32,34)