3-(2,5-dimethyl-7-oxidanylidene-3-phenyl-furo[3,2-g]chromen-6-yl)-N-[(2S)-4-methylsulfanyl-1-oxidanyl-butan-2-yl]propanamide

Systemtic Name: 3-(2,5-dimethyl-7-oxidanylidene-3-phenyl-furo[3,2-g]chromen-6-yl)-N-[(2S)-4-methylsulfanyl-1-oxidanyl-butan-2-yl]propanamide Openeye Name: 3-(2,5-dimethyl-7-oxo-3-phenyl-furo[3,2-g]chromen-6-yl)-N-[(1S)-1-(hydroxymethyl)-3-methylsulfanyl-propyl]propanamide CAS Name: 3-(2,5-dimethyl-7-oxo-3-phenyl-6-furo[3,2-g][1]benzopyranyl)-N-[(2S)-1-hydroxy-4-(methylthio)butan-2-yl]propanamide IUPAC Name: 3-(2,5-dimethyl-7-oxo-3-phenylfuro[3,2-g]chromen-6-yl)-N-[(2S)-1-hydroxy-4-methylsulfanylbutan-2-yl]propanamide Traditional Name: 3-(7-keto-2,5-dimethyl-3-phenyl-furo[3,2-g]chromen-6-yl)-N-[(1S)-1-methylol-3-(methylthio)propyl]propionamide Formula: C27H29NO5S MolecularWeight: 479.58786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29NO5S/c1-16-20(9-10-25(30)28-19(15-29)11-12-34-3)27(31)33-23-14-24-22(13-21(16)23)26(17(2)32-24)18-7-5-4-6-8-18/h4-8,13-14,19,29H,9-12,15H2,1-3H3,(H,28,30)/t19-/m0/s1