[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 3,6-dimethyl-4-oxidanylidene-furo[2,3-d]pyrimidine-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 3,6-dimethyl-4-oxidanylidene-furo[2,3-d]pyrimidine-5-carboxylate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3,6-dimethyl-4-oxo-furo[2,3-d]pyrimidine-5-carboxylate CAS Name: 3,6-dimethyl-4-oxo-5-furo[2,3-d]pyrimidinecarboxylic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3,6-dimethyl-4-oxofuro[2,3-d]pyrimidine-5-carboxylate Traditional Name: 4-keto-3,6-dimethyl-furo[2,3-d]pyrimidine-5-carboxylic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)N=CN(C2=O)C)C(=O)OCC(=O)NCCSC3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(O1)N=CN(C2=O)C)C(=O)OCC(=O)NCCSC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O5S/c1-12-15(16-17(27-12)21-11-22(2)18(16)24)19(25)26-10-14(23)20-8-9-28-13-6-4-3-5-7-13/h3-7,11H,8-10H2,1-2H3,(H,20,23)