[1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 5-propyl-1H-pyrazole-3-carboxylate

Systemtic Name: [1-[(3-cyanothiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl] 5-propyl-1H-pyrazole-3-carboxylate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-1-methyl-2-oxo-ethyl] 5-propyl-1H-pyrazole-3-carboxylate CAS Name: 5-propyl-1H-pyrazole-3-carboxylic acid [1-[(3-cyano-2-thiophenyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(3-cyanothiophen-2-yl)amino]-1-oxopropan-2-yl] 5-propyl-1H-pyrazole-3-carboxylate Traditional Name: 5-propyl-1H-pyrazole-3-carboxylic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C15H16N4O3S MolecularWeight: 332.37754

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NN1)C(=O)OC(C)C(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

CCCC1=CC(=NN1)C(=O)OC(C)C(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C15H16N4O3S/c1-3-4-11-7-12(19-18-11)15(21)22-9(2)13(20)17-14-10(8-16)5-6-23-14/h5-7,9H,3-4H2,1-2H3,(H,17,20)(H,18,19)