(3-ethoxycarbonyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-5-yl)methyl 1,3-benzothiazole-6-carboxylate

Systemtic Name: (3-ethoxycarbonyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidin-5-yl)methyl 1,3-benzothiazole-6-carboxylate Openeye Name: (3-ethoxycarbonyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl)methyl 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid (3-ethoxycarbonyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl)methyl ester IUPAC Name: (3-ethoxycarbonyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-5-yl)methyl 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid (3-carbethoxy-7-keto-1H-pyrazolo[1,5-a]pyrimidin-5-yl)methyl ester Formula: C18H14N4O5S MolecularWeight: 398.39256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNN2C1=NC(=CC2=O)COC(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CCOC(=O)C1=CNN2C1=NC(=CC2=O)COC(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C18H14N4O5S/c1-2-26-18(25)12-7-20-22-15(23)6-11(21-16(12)22)8-27-17(24)10-3-4-13-14(5-10)28-9-19-13/h3-7,9,20H,2,8H2,1H3