methyl (2R)-2-[(5-methoxy-3-methyl-1-benzofuran-2-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2R)-2-[(5-methoxy-3-methyl-1-benzofuran-2-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[(5-methoxy-3-methyl-benzofuran-2-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(5-methoxy-3-methyl-2-benzofuranyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(5-methoxy-3-methyl-1-benzofuran-2-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(5-methoxy-3-methyl-benzofuran-2-carbonyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C17H21NO5S MolecularWeight: 351.41734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)OC)C(=O)N[C@H](CCSC)C(=O)OC

InChI

InChI=1S/C17H21NO5S/c1-10-12-9-11(21-2)5-6-14(12)23-15(10)16(19)18-13(7-8-24-4)17(20)22-3/h5-6,9,13H,7-8H2,1-4H3,(H,18,19)/t13-/m1/s1