methyl 4-[(5-oxidanylidene-3-thiophen-2-yl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-7-yl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(5-oxidanylidene-3-thiophen-2-yl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-7-yl)carbonylamino]benzoate Openeye Name: methyl 4-[[5-oxo-3-(2-thienyl)-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carbonyl]amino]benzoate CAS Name: 4-[[oxo-(5-oxo-3-thiophen-2-yl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-7-yl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-oxo-3-thiophen-2-yl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carbonyl)amino]benzoate Traditional Name: 4-[[5-keto-3-(2-thienyl)-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidine-7-carbonyl]amino]benzoic acid methyl ester Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N=C3N2NC=C3C4=CC=CS4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)N=C3N2NC=C3C4=CC=CS4

InChI

InChI=1S/C19H16N4O4S/c1-27-19(26)11-4-6-12(7-5-11)21-18(25)14-9-16(24)22-17-13(10-20-23(14)17)15-3-2-8-28-15/h2-8,10,14,20H,9H2,1H3,(H,21,25)