[2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Openeye Name: [2-(1-methylbutylamino)-2-oxo-ethyl] 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate CAS Name: 1,3-dimethyl-5-thieno[2,3-c]pyrazolecarboxylic acid [2-oxo-2-(pentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-2-ylamino)ethyl] 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylate Traditional Name: 1,3-dimethylthieno[2,3-c]pyrazole-5-carboxylic acid [2-keto-2-(1-methylbutylamino)ethyl] ester Formula: C15H21N3O3S MolecularWeight: 323.41054

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=CC2=C(S1)N(N=C2C)C

Isomeric SMILES

CCCC(C)NC(=O)COC(=O)C1=CC2=C(S1)N(N=C2C)C

InChI

InChI=1S/C15H21N3O3S/c1-5-6-9(2)16-13(19)8-21-15(20)12-7-11-10(3)17-18(4)14(11)22-12/h7,9H,5-6,8H2,1-4H3,(H,16,19)