(2S)-2-[3-(5-methyl-7-oxidanylidene-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[3-(5-methyl-7-oxidanylidene-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[3-(5-methyl-7-oxo-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[3-(5-methyl-7-oxo-3-phenyl-6-furo[3,2-g][1]benzopyranyl)-1-oxopropyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[3-(5-methyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)propanoylamino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[3-(7-keto-5-methyl-3-phenyl-furo[3,2-g]chromen-6-yl)propanoylamino]-4-(methylthio)butyrate Formula: C26H24NO6S- MolecularWeight: 478.53686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C4=CC=CC=C4)CCC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C4=CC=CC=C4)CCC(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C26H25NO6S/c1-15-17(8-9-24(28)27-21(25(29)30)10-11-34-2)26(31)33-23-13-22-19(12-18(15)23)20(14-32-22)16-6-4-3-5-7-16/h3-7,12-14,21H,8-11H2,1-2H3,(H,27,28)(H,29,30)/p-1/t21-/m0/s1