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

Systemtic Name: methyl (2R)-2-[(3-methyl-5-propyl-1-benzofuran-2-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2R)-2-[(3-methyl-5-propyl-benzofuran-2-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[(3-methyl-5-propyl-2-benzofuranyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(3-methyl-5-propyl-1-benzofuran-2-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(3-methyl-5-propyl-benzofuran-2-carbonyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C19H25NO4S MolecularWeight: 363.4711

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)OC(=C2C)C(=O)NC(CCSC)C(=O)OC

Isomeric SMILES

CCCC1=CC2=C(C=C1)OC(=C2C)C(=O)N[C@H](CCSC)C(=O)OC

InChI

InChI=1S/C19H25NO4S/c1-5-6-13-7-8-16-14(11-13)12(2)17(24-16)18(21)20-15(9-10-25-4)19(22)23-3/h7-8,11,15H,5-6,9-10H2,1-4H3,(H,20,21)/t15-/m1/s1