[(2S)-1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 2-[(phenylmethyl)amino]-1,3-thiazole-4-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-(thiophen-2-ylmethylamino)propan-2-yl] 2-[(phenylmethyl)amino]-1,3-thiazole-4-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(2-thienylmethylamino)ethyl] 2-(benzylamino)thiazole-4-carboxylate CAS Name: 2-[(phenylmethyl)amino]-4-thiazolecarboxylic 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-(benzylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(benzylamino)thiazole-4-carboxylic acid [(1S)-2-keto-1-methyl-2-(2-thenylamino)ethyl] ester Formula: C19H19N3O3S2 MolecularWeight: 401.50246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)OC(=O)C2=CSC(=N2)NCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CS1)OC(=O)C2=CSC(=N2)NCC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O3S2/c1-13(17(23)20-11-15-8-5-9-26-15)25-18(24)16-12-27-19(22-16)21-10-14-6-3-2-4-7-14/h2-9,12-13H,10-11H2,1H3,(H,20,23)(H,21,22)/t13-/m0/s1