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

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-3-[2-oxidanylidene-2-(2-phenylpropylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-3-[2-oxo-2-(2-phenylpropylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[2-oxo-2-(2-phenylpropylamino)ethyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-3-[2-oxo-2-(2-phenylpropylamino)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-[2-keto-2-(2-phenylpropylamino)ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC(=O)NCC(C)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC(=O)NCC(C)C3=CC=CC=C3)C

InChI

InChI=1S/C21H23N3O4S/c1-4-28-21(27)18-14(3)17-19(29-18)23-12-24(20(17)26)11-16(25)22-10-13(2)15-8-6-5-7-9-15/h5-9,12-13H,4,10-11H2,1-3H3,(H,22,25)