ethyl 1-phenyl-5-[(5-thiophen-2-yl-1H-pyrazol-3-yl)carbonylamino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-phenyl-5-[(5-thiophen-2-yl-1H-pyrazol-3-yl)carbonylamino]pyrazole-4-carboxylate Openeye Name: ethyl 1-phenyl-5-[[5-(2-thienyl)-1H-pyrazole-3-carbonyl]amino]pyrazole-4-carboxylate CAS Name: 5-[[oxo-(5-thiophen-2-yl-1H-pyrazol-3-yl)methyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-phenyl-5-[(5-thiophen-2-yl-1H-pyrazole-3-carbonyl)amino]pyrazole-4-carboxylate Traditional Name: 1-phenyl-5-[[5-(2-thienyl)-1H-pyrazole-3-carbonyl]amino]pyrazole-4-carboxylic acid ethyl ester Formula: C20H17N5O3S MolecularWeight: 407.44568

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=NNC(=C3)C4=CC=CS4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=NNC(=C3)C4=CC=CS4

InChI

InChI=1S/C20H17N5O3S/c1-2-28-20(27)14-12-21-25(13-7-4-3-5-8-13)18(14)22-19(26)16-11-15(23-24-16)17-9-6-10-29-17/h3-12H,2H2,1H3,(H,22,26)(H,23,24)