3-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxidanylidene-chromen-3-yl]-N-[(2S)-4-methylsulfanyl-1-oxidanyl-butan-2-yl]propanamide

Systemtic Name: 3-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxidanylidene-chromen-3-yl]-N-[(2S)-4-methylsulfanyl-1-oxidanyl-butan-2-yl]propanamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-3-methylsulfanyl-propyl]-3-[4-methyl-7-(2-methylallyloxy)-2-oxo-chromen-3-yl]propanamide CAS Name: N-[(2S)-1-hydroxy-4-(methylthio)butan-2-yl]-3-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxo-1-benzopyran-3-yl]propanamide IUPAC Name: N-[(2S)-1-hydroxy-4-methylsulfanylbutan-2-yl]-3-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxochromen-3-yl]propanamide Traditional Name: 3-[2-keto-4-methyl-7-(2-methylallyloxy)chromen-3-yl]-N-[(1S)-1-methylol-3-(methylthio)propyl]propionamide Formula: C22H29NO5S MolecularWeight: 419.53436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=C)C)CCC(=O)NC(CCSC)CO

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=C)C)CCC(=O)N[C@@H](CCSC)CO

InChI

InChI=1S/C22H29NO5S/c1-14(2)13-27-17-5-6-18-15(3)19(22(26)28-20(18)11-17)7-8-21(25)23-16(12-24)9-10-29-4/h5-6,11,16,24H,1,7-10,12-13H2,2-4H3,(H,23,25)/t16-/m0/s1