[(2S)-1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 2-azanyl-3-chloranyl-benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 2-azanyl-3-chloranyl-benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl] 2-amino-3-chloro-benzoate CAS Name: 2-amino-3-chlorobenzoic acid [(2S)-1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(thiophen-2-ylmethylamino)propan-2-yl] 2-amino-3-chlorobenzoate Traditional Name: 2-amino-3-chloro-benzoic acid [(1S)-2-keto-1-methyl-2-(2-thenylamino)ethyl] ester Formula: C15H15ClN2O3S MolecularWeight: 338.8092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)OC(=O)C2=C(C(=CC=C2)Cl)N

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CS1)OC(=O)C2=C(C(=CC=C2)Cl)N

InChI

InChI=1S/C15H15ClN2O3S/c1-9(14(19)18-8-10-4-3-7-22-10)21-15(20)11-5-2-6-12(16)13(11)17/h2-7,9H,8,17H2,1H3,(H,18,19)/t9-/m0/s1