methyl (2R,3S)-2-[2-[2-(4-methoxyphenyl)sulfanylethanoyloxy]ethanoylamino]-3-methyl-pentanoate

Systemtic Name: methyl (2R,3S)-2-[2-[2-(4-methoxyphenyl)sulfanylethanoyloxy]ethanoylamino]-3-methyl-pentanoate Openeye Name: methyl (2R,3S)-2-[[2-[2-(4-methoxyphenyl)sulfanylacetyl]oxyacetyl]amino]-3-methyl-pentanoate CAS Name: (2R,3S)-2-[[2-[2-[(4-methoxyphenyl)thio]-1-oxoethoxy]-1-oxoethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl (2R,3S)-2-[[2-[2-(4-methoxyphenyl)sulfanylacetyl]oxyacetyl]amino]-3-methylpentanoate Traditional Name: (2R,3S)-2-[[2-[2-[(4-methoxyphenyl)thio]acetyl]oxyacetyl]amino]-3-methyl-valeric acid methyl ester Formula: C18H25NO6S MolecularWeight: 383.4592

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)COC(=O)CSC1=CC=C(C=C1)OC

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)OC)NC(=O)COC(=O)CSC1=CC=C(C=C1)OC

InChI

InChI=1S/C18H25NO6S/c1-5-12(2)17(18(22)24-4)19-15(20)10-25-16(21)11-26-14-8-6-13(23-3)7-9-14/h6-9,12,17H,5,10-11H2,1-4H3,(H,19,20)/t12-,17+/m0/s1