[4-(thiophen-2-ylcarbonylamino)phenyl] 5-chloranyl-1,3-dimethyl-pyrazole-4-carboxylate

Systemtic Name: [4-(thiophen-2-ylcarbonylamino)phenyl] 5-chloranyl-1,3-dimethyl-pyrazole-4-carboxylate Openeye Name: [4-(thiophene-2-carbonylamino)phenyl] 5-chloro-1,3-dimethyl-pyrazole-4-carboxylate CAS Name: 5-chloro-1,3-dimethyl-4-pyrazolecarboxylic acid [4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: [4-(thiophene-2-carbonylamino)phenyl] 5-chloro-1,3-dimethylpyrazole-4-carboxylate Traditional Name: 5-chloro-1,3-dimethyl-pyrazole-4-carboxylic acid [4-(2-thenoylamino)phenyl] ester Formula: C17H14ClN3O3S MolecularWeight: 375.82936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CS3)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)OC2=CC=C(C=C2)NC(=O)C3=CC=CS3)Cl)C

InChI

InChI=1S/C17H14ClN3O3S/c1-10-14(15(18)21(2)20-10)17(23)24-12-7-5-11(6-8-12)19-16(22)13-4-3-9-25-13/h3-9H,1-2H3,(H,19,22)