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

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 1-(3-chlorophenyl)-3-methyl-thieno[2,3-c]pyrazole-5-carboxylate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 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 [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 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 [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)C1=CC2=C(S1)N(N=C2C)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)C1=CC2=C(S1)N(N=C2C)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H18ClN3O3S/c1-4-20-16(23)11(3)25-18(24)15-9-14-10(2)21-22(17(14)26-15)13-7-5-6-12(19)8-13/h5-9,11H,4H2,1-3H3,(H,20,23)/t11-/m0/s1