methyl (2R)-2-[2-(2-methyl-4-oxidanylidene-3-phenoxy-chromen-7-yl)oxyethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[2-(2-methyl-4-oxidanylidene-3-phenoxy-chromen-7-yl)oxyethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[[2-(2-methyl-4-oxo-3-phenoxy-chromen-7-yl)oxyacetyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[2-[(2-methyl-4-oxo-3-phenoxy-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-(2-methyl-4-oxo-3-phenoxychromen-7-yl)oxyacetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[2-(4-keto-2-methyl-3-phenoxy-chromen-7-yl)oxyacetyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C24H25NO7S MolecularWeight: 471.5228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)NC(CCSC)C(=O)OC)OC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)N[C@H](CCSC)C(=O)OC)OC3=CC=CC=C3

InChI

InChI=1S/C24H25NO7S/c1-15-23(32-16-7-5-4-6-8-16)22(27)18-10-9-17(13-20(18)31-15)30-14-21(26)25-19(11-12-33-3)24(28)29-2/h4-10,13,19H,11-12,14H2,1-3H3,(H,25,26)/t19-/m1/s1