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

Systemtic Name: ethyl 2-[2-[(2S)-2-benzamido-3-methyl-butanoyl]oxyethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[2-[(2S)-2-benzamido-3-methyl-butanoyl]oxyacetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[(2S)-2-benzamido-3-methyl-1-oxobutoxy]-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(2S)-2-benzamido-3-methylbutanoyl]oxyacetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[(2S)-2-benzamido-3-methyl-butanoyl]oxyacetyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC(=O)COC(=O)[C@H](C(C)C)NC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C21H25N3O6S/c1-5-29-20(28)17-13(4)22-21(31-17)23-15(25)11-30-19(27)16(12(2)3)24-18(26)14-9-7-6-8-10-14/h6-10,12,16H,5,11H2,1-4H3,(H,24,26)(H,22,23,25)/t16-/m0/s1