(Q27287993)

Cenicriviroc mesylate (English)

14 October 2016

chemical formula

C₄₂H₅₆N₄O₇S₂

1 reference

Cenicriviroc mesylate (English)

14 October 2016

canonical SMILES

CCCCOCCOC1=CC=C(C=C1)C2=CC3=C(C=C2)N(CCCC(=C3)C(=O)NC4=CC=C(C=C4)S(=O)CC5=CN=CN5CCC)CC(C)C.CS(=O)(=O)O

1 reference

Cenicriviroc mesylate (English)

14 October 2016

isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C2=CC/3=C(C=C2)N(CCC/C(=C3)/C(=O)NC4=CC=C(C=C4)[S@@](=O)CC5=CN=CN5CCC)CC(C)C.CS(=O)(=O)O

1 reference

Cenicriviroc mesylate (English)

InChI=1S/C41H52N4O4S.CH4O3S/c1-5-7-22-48-23-24-49-38-15-10-32(11-16-38)33-12-19-40-35(25-33)26-34(9-8-21-44(40)28-31(3)4)41(46)43-36-13-17-39(18-14-36)50(47)29-37-27-42-30-45(37)20-6-2;1-5(2,3)4/h10-19,25-27,30-31H,5-9,20-24,28-29H2,1-4H3,(H,43,46);1H3,(H,2,3,4)/b34-26+;/t50-;/m0./s1

14 October 2016

Identifiers

InChI

1 reference

Cenicriviroc mesylate (English)

IXPBPUPDRDCRSY-YLZLUMLXSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

Cenicriviroc mesylate (English)

14 October 2016

1 reference

UNII

R96TV84T21

cenicriviroc mesylate (English)

14 October 2016

1 reference

Cenicriviroc mesylate (English)

14 October 2016

2 references

Cenicriviroc mesylate (English)

matched by identifier from

14 October 2016

InChIKey

IXPBPUPDRDCRSY-YLZLUMLXSA-N

1 reference

Global Substance Registration System

CENICRIVIROC MESYLATE (English)

14 October 2016

1 reference

2 references

UNII

R96TV84T21

cenicriviroc mesylate (English)