tert-butyl 5-(4-chlorophenyl)-3-thiophen-2-yl-3,4-dihydropyrazole-2-carboxylate

Systemtic Name: tert-butyl 5-(4-chlorophenyl)-3-thiophen-2-yl-3,4-dihydropyrazole-2-carboxylate Openeye Name: tert-butyl 5-(4-chlorophenyl)-3-(2-thienyl)-3,4-dihydropyrazole-2-carboxylate CAS Name: 5-(4-chlorophenyl)-3-thiophen-2-yl-3,4-dihydropyrazole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(4-chlorophenyl)-3-thiophen-2-yl-3,4-dihydropyrazole-2-carboxylate Traditional Name: 3-(4-chlorophenyl)-5-(2-thienyl)-2-pyrazoline-1-carboxylic acid tert-butyl ester Formula: C18H19ClN2O2S MolecularWeight: 362.87366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(CC(=N1)C2=CC=C(C=C2)Cl)C3=CC=CS3

Isomeric SMILES

CC(C)(C)OC(=O)N1C(CC(=N1)C2=CC=C(C=C2)Cl)C3=CC=CS3

InChI

InChI=1S/C18H19ClN2O2S/c1-18(2,3)23-17(22)21-15(16-5-4-10-24-16)11-14(20-21)12-6-8-13(19)9-7-12/h4-10,15H,11H2,1-3H3