ethyl 5-methyl-1-[3-(2-thiophen-2-ylethanoylamino)phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[3-(2-thiophen-2-ylethanoylamino)phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[3-[[2-(2-thienyl)acetyl]amino]phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[3-[(1-oxo-2-thiophen-2-ylethyl)amino]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[3-[(2-thiophen-2-ylacetyl)amino]phenyl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[3-[[2-(2-thienyl)acetyl]amino]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)CC3=CC=CS3)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)NC(=O)CC3=CC=CS3)C

InChI

InChI=1S/C19H19N3O3S/c1-3-25-19(24)17-12-20-22(13(17)2)15-7-4-6-14(10-15)21-18(23)11-16-8-5-9-26-16/h4-10,12H,3,11H2,1-2H3,(H,21,23)