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

Systemtic Name: ethyl 4-[(5-oxidanylidene-3-thiophen-2-yl-6,7-dihydro-1H-pyrazolo[1,5-a]pyrimidin-7-yl)carbonylamino]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O4S/c1-2-28-20(27)12-5-7-13(8-6-12)22-19(26)15-10-17(25)23-18-14(11-21-24(15)18)16-4-3-9-29-16/h3-9,11,15,21H,2,10H2,1H3,(H,22,26)