dilithium 2-[[2-(2-methylphenyl)-4-[(4-methylsulfanyl-1-oxidanidyloxy-butan-2-yl)carbamoyl]phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: dilithium 2-[[2-(2-methylphenyl)-4-[(4-methylsulfanyl-1-oxidanidyloxy-butan-2-yl)carbamoyl]phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: dilithium 4-methylsulfanyl-2-[[4-[[3-methylsulfanyl-1-(oxidooxymethyl)propyl]carbamoyl]-2-(o-tolyl)benzoyl]amino]butanoate CAS Name: dilithium 2-[[[2-(2-methylphenyl)-4-[[[4-(methylthio)-1-oxidooxybutan-2-yl]amino]-oxomethyl]phenyl]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: dilithium 2-[[2-(2-methylphenyl)-4-[(4-methylsulfanyl-1-oxidooxybutan-2-yl)carbamoyl]benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: dilithium 4-(methylthio)-2-[[4-[[3-(methylthio)-1-(oxidooxymethyl)propyl]carbamoyl]-2-(o-tolyl)benzoyl]amino]butyrate Formula: C25H30Li2N2O6S2 MolecularWeight: 532.5275

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].[Li+].CC1=CC=CC=C1C2=C(C=CC(=C2)C(=O)NC(CCSC)CO[O-])C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

[Li+].[Li+].CC1=CC=CC=C1C2=C(C=CC(=C2)C(=O)NC(CCSC)CO[O-])C(=O)NC(CCSC)C(=O)[O-]

InChI

InChI=1S/C25H32N2O6S2.2Li/c1-16-6-4-5-7-19(16)21-14-17(23(28)26-18(15-33-32)10-12-34-2)8-9-20(21)24(29)27-22(25(30)31)11-13-35-3;;/h4-9,14,18,22,32H,10-13,15H2,1-3H3,(H,26,28)(H,27,29)(H,30,31);;/q;2*+1/p-2