ethyl 3-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 3-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethyleneamino]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)N=CC3=CC4=C(C=C3)OCCO4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)/N=C/C3=CC4=C(C=C3)OCCO4)C

InChI

InChI=1S/C19H17N3O5S/c1-3-25-19(24)16-11(2)15-17(28-16)20-10-22(18(15)23)21-9-12-4-5-13-14(8-12)27-7-6-26-13/h4-5,8-10H,3,6-7H2,1-2H3/b21-9+