[2-(butylamino)-2-oxidanylidene-ethyl] 3-phenylthiophene-2-carboxylate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 3-phenylthiophene-2-carboxylate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 3-phenylthiophene-2-carboxylate CAS Name: 3-phenyl-2-thiophenecarboxylic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 3-phenylthiophene-2-carboxylate Traditional Name: 3-phenylthiophene-2-carboxylic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C17H19NO3S MolecularWeight: 317.40266

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=C(C=CS1)C2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=C(C=CS1)C2=CC=CC=C2

InChI

InChI=1S/C17H19NO3S/c1-2-3-10-18-15(19)12-21-17(20)16-14(9-11-22-16)13-7-5-4-6-8-13/h4-9,11H,2-3,10,12H2,1H3,(H,18,19)