lithium 2-[[2-(2-methylphenyl)-4-(2-piperidin-1-ylethylsulfamoyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: lithium 2-[[2-(2-methylphenyl)-4-(2-piperidin-1-ylethylsulfamoyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: lithium 4-methylsulfanyl-2-[[2-(o-tolyl)-4-[2-(1-piperidyl)ethylsulfamoyl]benzoyl]amino]butanoate CAS Name: lithium 2-[[[2-(2-methylphenyl)-4-[2-(1-piperidinyl)ethylsulfamoyl]phenyl]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: lithium 2-[[2-(2-methylphenyl)-4-(2-piperidin-1-ylethylsulfamoyl)benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: lithium 4-(methylthio)-2-[[2-(o-tolyl)-4-(2-piperidinoethylsulfamoyl)benzoyl]amino]butyrate Formula: C26H34LiN3O5S2 MolecularWeight: 539.63626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[Li+].CC1=CC=CC=C1C2=C(C=CC(=C2)S(=O)(=O)NCCN3CCCCC3)C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

[Li+].CC1=CC=CC=C1C2=C(C=CC(=C2)S(=O)(=O)NCCN3CCCCC3)C(=O)NC(CCSC)C(=O)[O-]

InChI

InChI=1S/C26H35N3O5S2.Li/c1-19-8-4-5-9-21(19)23-18-20(36(33,34)27-13-16-29-14-6-3-7-15-29)10-11-22(23)25(30)28-24(26(31)32)12-17-35-2;/h4-5,8-11,18,24,27H,3,6-7,12-17H2,1-2H3,(H,28,30)(H,31,32);/q;+1/p-1