methyl 4-oxidanylidene-5-(thiophen-2-ylmethyl)-6,7-dihydropyrazolo[1,5-a]pyrazine-3-carboxylate

Systemtic Name: methyl 4-oxidanylidene-5-(thiophen-2-ylmethyl)-6,7-dihydropyrazolo[1,5-a]pyrazine-3-carboxylate Openeye Name: methyl 4-oxo-5-(2-thienylmethyl)-6,7-dihydropyrazolo[1,5-a]pyrazine-3-carboxylate CAS Name: 4-oxo-5-(thiophen-2-ylmethyl)-6,7-dihydropyrazolo[1,5-a]pyrazine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-5-(thiophen-2-ylmethyl)-6,7-dihydropyrazolo[1,5-a]pyrazine-3-carboxylate Traditional Name: 4-keto-5-(2-thenyl)-6,7-dihydropyrazolo[1,5-a]pyrazine-3-carboxylic acid methyl ester Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=O)N(CCN2N=C1)CC3=CC=CS3

Isomeric SMILES

COC(=O)C1=C2C(=O)N(CCN2N=C1)CC3=CC=CS3

InChI

InChI=1S/C13H13N3O3S/c1-19-13(18)10-7-14-16-5-4-15(12(17)11(10)16)8-9-3-2-6-20-9/h2-3,6-7H,4-5,8H2,1H3