lithium 4-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]benzenesulfonate

Systemtic Name: lithium 4-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]benzenesulfonate Openeye Name: lithium 4-[[4-(p-tolyl)thiazol-2-yl]amino]benzenesulfonate CAS Name: lithium 4-[[4-(4-methylphenyl)-2-thiazolyl]amino]benzenesulfonate IUPAC Name: lithium 4-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]benzenesulfonate Traditional Name: lithium 4-[[4-(p-tolyl)thiazol-2-yl]amino]besylate Formula: C16H13LiN2O3S2 MolecularWeight: 352.35702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[Li+].CC1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)S(=O)(=O)[O-]

Isomeric SMILES

[Li+].CC1=CC=C(C=C1)C2=CSC(=N2)NC3=CC=C(C=C3)S(=O)(=O)[O-]

InChI

InChI=1S/C16H14N2O3S2.Li/c1-11-2-4-12(5-3-11)15-10-22-16(18-15)17-13-6-8-14(9-7-13)23(19,20)21;/h2-10H,1H3,(H,17,18)(H,19,20,21);/q;+1/p-1