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

Systemtic Name: phenethyl 3-[2-(dipropylamino)-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 3-[2-(dipropylamino)-2-oxo-ethyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[2-(dipropylamino)-2-oxoethyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid phenethyl ester IUPAC Name: phenethyl 3-[2-(dipropylamino)-2-oxoethyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[2-(dipropylamino)-2-keto-ethyl]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CN1C=NC2=C(C1=O)C(=C(S2)C(=O)OCCC3=CC=CC=C3)C

Isomeric SMILES

CCCN(CCC)C(=O)CN1C=NC2=C(C1=O)C(=C(S2)C(=O)OCCC3=CC=CC=C3)C

InChI

InChI=1S/C24H29N3O4S/c1-4-12-26(13-5-2)19(28)15-27-16-25-22-20(23(27)29)17(3)21(32-22)24(30)31-14-11-18-9-7-6-8-10-18/h6-10,16H,4-5,11-15H2,1-3H3