(2-butoxy-2-oxidanylidene-ethyl) 1-(2-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (2-butoxy-2-oxidanylidene-ethyl) 1-(2-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (2-butoxy-2-oxo-ethyl) 1-(2-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-(2-chlorophenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid (2-butoxy-2-oxoethyl) ester IUPAC Name: (2-butoxy-2-oxoethyl) 1-(2-chlorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(2-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid (2-butoxy-2-keto-ethyl) ester Formula: C19H19ClN2O4S MolecularWeight: 406.88316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)COC(=O)C1=CC2=C(S1)N(N=C2C)C3=CC=CC=C3Cl

Isomeric SMILES

CCCCOC(=O)COC(=O)C1=CC2=C(S1)N(N=C2C)C3=CC=CC=C3Cl

InChI

InChI=1S/C19H19ClN2O4S/c1-3-4-9-25-17(23)11-26-19(24)16-10-13-12(2)21-22(18(13)27-16)15-8-6-5-7-14(15)20/h5-8,10H,3-4,9,11H2,1-2H3