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

Systemtic Name: [(2S)-1-azanyl-1-oxidanylidene-propan-2-yl] 1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: [(1S)-2-amino-1-methyl-2-oxo-ethyl] 1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1-(4-chlorophenyl)-3-methyl-5-thieno[2,3-c]pyrazolecarboxylic acid [(2S)-1-amino-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-amino-1-oxopropan-2-yl] 1-(4-chlorophenyl)-3-methylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1-(4-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylic acid [(1S)-2-amino-2-keto-1-methyl-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)OC(C)C(=O)N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NN(C2=C1C=C(S2)C(=O)O[C@@H](C)C(=O)N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H14ClN3O3S/c1-8-12-7-13(16(22)23-9(2)14(18)21)24-15(12)20(19-8)11-5-3-10(17)4-6-11/h3-7,9H,1-2H3,(H2,18,21)/t9-/m0/s1