dibenzofuran-2-yl 1-[(2-chlorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: dibenzofuran-2-yl 1-[(2-chlorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: dibenzofuran-2-yl 1-[(2-chlorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-[(2-chlorophenyl)methyl]-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid 2-dibenzofuranyl ester IUPAC Name: dibenzofuran-2-yl 1-[(2-chlorophenyl)methyl]-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(2-chlorobenzyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid dibenzofuran-2-yl ester Formula: C26H17ClN2O3S MolecularWeight: 472.94278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OC3=CC4=C(C=C3)OC5=CC=CC=C54)CC6=CC=CC=C6Cl

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OC3=CC4=C(C=C3)OC5=CC=CC=C54)CC6=CC=CC=C6Cl

InChI

InChI=1S/C26H17ClN2O3S/c1-15-19-13-24(33-25(19)29(28-15)14-16-6-2-4-8-21(16)27)26(30)31-17-10-11-23-20(12-17)18-7-3-5-9-22(18)32-23/h2-13H,14H2,1H3