(2-azanyl-2-oxidanylidene-ethyl) 1-[(4-chlorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 1-[(4-chlorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: (2-amino-2-oxo-ethyl) 1-[(4-chlorophenyl)methyl]-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-[(4-chlorophenyl)methyl]-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 1-[(4-chlorophenyl)methyl]-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(4-chlorobenzyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid (2-amino-2-keto-ethyl) ester Formula: C16H14ClN3O3S MolecularWeight: 363.81866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=C(S2)C(=O)OCC(=O)N)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)OCC(=O)N)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H14ClN3O3S/c1-9-12-6-13(16(22)23-8-14(18)21)24-15(12)20(19-9)7-10-2-4-11(17)5-3-10/h2-6H,7-8H2,1H3,(H2,18,21)