ethyl 2-azanyl-4-[3-(3-oxidanylidene-1,2-dihydropyrazol-4-yl)propylamino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[3-(3-oxidanylidene-1,2-dihydropyrazol-4-yl)propylamino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-amino-4-[3-(3-oxo-1,2-dihydropyrazol-4-yl)propylamino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-amino-4-[3-(3-oxo-1,2-dihydropyrazol-4-yl)propylamino]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-[3-(3-oxo-1,2-dihydropyrazol-4-yl)propylamino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-amino-4-[3-(3-keto-3-pyrazolin-4-yl)propylamino]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C15H18N6O3S MolecularWeight: 362.40682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N=C(N=C2S1)N)NCCCC3=CNNC3=O

Isomeric SMILES

CCOC(=O)C1=CC2=C(N=C(N=C2S1)N)NCCCC3=CNNC3=O

InChI

InChI=1S/C15H18N6O3S/c1-2-24-14(23)10-6-9-11(19-15(16)20-13(9)25-10)17-5-3-4-8-7-18-21-12(8)22/h6-7H,2-5H2,1H3,(H2,18,21,22)(H3,16,17,19,20)