ethyl 2-(pyrazolo[1,5-a]pyrimidin-2-ylcarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-(pyrazolo[1,5-a]pyrimidin-2-ylcarbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[oxo(2-pyrazolo[1,5-a]pyrimidinyl)methyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-(pyrazolo[1,5-a]pyrimidine-2-carbonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NN4C=CC=NC4=C3

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NN4C=CC=NC4=C3

InChI

InChI=1S/C18H18N4O3S/c1-2-25-18(24)15-11-6-3-4-7-13(11)26-17(15)20-16(23)12-10-14-19-8-5-9-22(14)21-12/h5,8-10H,2-4,6-7H2,1H3,(H,20,23)