ethyl 4-(3,4-dihydro-2H-chromen-4-ylamino)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 4-(3,4-dihydro-2H-chromen-4-ylamino)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 4-(chroman-4-ylamino)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(3,4-dihydro-2H-1-benzopyran-4-ylamino)-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dihydro-2H-chromen-4-ylamino)-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(chroman-4-ylamino)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)C)NC3CCOC4=CC=CC=C34)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N=C(N=C2S1)C)NC3CCOC4=CC=CC=C34)C

InChI

InChI=1S/C20H21N3O3S/c1-4-25-20(24)17-11(2)16-18(21-12(3)22-19(16)27-17)23-14-9-10-26-15-8-6-5-7-13(14)15/h5-8,14H,4,9-10H2,1-3H3,(H,21,22,23)