lithium 2-[[4-[(furan-2-ylmethylamino)methyl]-2-phenyl-phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: lithium 2-[[4-[(furan-2-ylmethylamino)methyl]-2-phenyl-phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: lithium 2-[[4-[(2-furylmethylamino)methyl]-2-phenyl-benzoyl]amino]-4-methylsulfanyl-butanoate CAS Name: lithium 2-[[[4-[(2-furanylmethylamino)methyl]-2-phenylphenyl]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: lithium 2-[[4-[(furan-2-ylmethylamino)methyl]-2-phenylbenzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: lithium 2-[[4-[(2-furfurylamino)methyl]-2-phenyl-benzoyl]amino]-4-(methylthio)butyrate Formula: C24H25LiN2O4S MolecularWeight: 444.4723

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CSCCC(C(=O)[O-])NC(=O)C1=C(C=C(C=C1)CNCC2=CC=CO2)C3=CC=CC=C3

Isomeric SMILES

[Li+].CSCCC(C(=O)[O-])NC(=O)C1=C(C=C(C=C1)CNCC2=CC=CO2)C3=CC=CC=C3

InChI

InChI=1S/C24H26N2O4S.Li/c1-31-13-11-22(24(28)29)26-23(27)20-10-9-17(15-25-16-19-8-5-12-30-19)14-21(20)18-6-3-2-4-7-18;/h2-10,12,14,22,25H,11,13,15-16H2,1H3,(H,26,27)(H,28,29);/q;+1/p-1