[2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 4-chloranyl-2-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 4-chloranyl-2-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: [2-[[(1S)-1-methylbutyl]amino]-2-oxo-ethyl] 4-chloro-2-(thiophene-2-carbonylamino)benzoate CAS Name: 4-chloro-2-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] 4-chloro-2-(thiophene-2-carbonylamino)benzoate Traditional Name: 4-chloro-2-(2-thenoylamino)benzoic acid [2-keto-2-[[(1S)-1-methylbutyl]amino]ethyl] ester Formula: C19H21ClN2O4S MolecularWeight: 408.89904

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)C2=CC=CS2

Isomeric SMILES

CCC[C@H](C)NC(=O)COC(=O)C1=C(C=C(C=C1)Cl)NC(=O)C2=CC=CS2

InChI

InChI=1S/C19H21ClN2O4S/c1-3-5-12(2)21-17(23)11-26-19(25)14-8-7-13(20)10-15(14)22-18(24)16-6-4-9-27-16/h4,6-10,12H,3,5,11H2,1-2H3,(H,21,23)(H,22,24)/t12-/m0/s1