[1-[(2-butan-2-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] thiophene-2-carboxylate

Systemtic Name: [1-[(2-butan-2-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] thiophene-2-carboxylate Openeye Name: [1-methyl-2-oxo-2-(2-sec-butylanilino)ethyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [1-(2-butan-2-ylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-butan-2-ylanilino)-1-oxopropan-2-yl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [2-keto-1-methyl-2-(2-sec-butylanilino)ethyl] ester Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C(C)OC(=O)C2=CC=CS2

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)C(C)OC(=O)C2=CC=CS2

InChI

InChI=1S/C18H21NO3S/c1-4-12(2)14-8-5-6-9-15(14)19-17(20)13(3)22-18(21)16-10-7-11-23-16/h5-13H,4H2,1-3H3,(H,19,20)