ethyl 2-[2-[2-benzamido-3-(phenylmethylsulfanyl)propanoyl]oxyethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[2-[2-benzamido-3-(phenylmethylsulfanyl)propanoyl]oxyethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[2-(2-benzamido-3-benzylsulfanyl-propanoyl)oxyacetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[2-benzamido-1-oxo-3-(phenylmethylthio)propoxy]-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-benzamido-3-benzylsulfanylpropanoyl)oxyacetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[2-benzamido-3-(benzylthio)propanoyl]oxyacetyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C26H27N3O6S2 MolecularWeight: 541.63908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC(=O)COC(=O)C(CSCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)COC(=O)C(CSCC2=CC=CC=C2)NC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C26H27N3O6S2/c1-3-34-25(33)22-17(2)27-26(37-22)29-21(30)14-35-24(32)20(16-36-15-18-10-6-4-7-11-18)28-23(31)19-12-8-5-9-13-19/h4-13,20H,3,14-16H2,1-2H3,(H,28,31)(H,27,29,30)