(4-tert-butylphenyl)methyl 1-(3-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (4-tert-butylphenyl)methyl 1-(3-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (4-tert-butylphenyl)methyl 1-(3-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-(3-chlorophenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid (4-tert-butylphenyl)methyl ester IUPAC Name: (4-tert-butylphenyl)methyl 1-(3-chlorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(3-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid (4-tert-butylbenzyl) ester Formula: C24H23ClN2O2S MolecularWeight: 438.96962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=CC=C(C=C3)C(C)(C)C)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC3=CC=C(C=C3)C(C)(C)C)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H23ClN2O2S/c1-15-20-13-21(30-22(20)27(26-15)19-7-5-6-18(25)12-19)23(28)29-14-16-8-10-17(11-9-16)24(2,3)4/h5-13H,14H2,1-4H3