(Q27123614)

ZINC87515704 (English)

6 October 2016

chemical formula

C₄₁H₅₄N₆S₂⁴⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CN1C2=CC=CC=C2SC1=CC3=CC=[N+](C=C3)CCC[N+](C)(C)CCC[N+](C)(C)CCC[N+]4=CC=C(C=C4)C=C5N(C6=CC=CC=C6S5)C

1 reference

ZINC87515704 (English)

InChI=1S/C41H54N6S2/c1-42-36-14-7-9-16-38(36)48-40(42)32-34-18-24-44(25-19-34)22-11-28-46(3,4)30-13-31-47(5,6)29-12-23-45-26-20-35(21-27-45)33-41-43(2)37-15-8-10-17-39(37)49-41/h7-10,14-21,24-27,32-33H,11-13,22-23,28-31H2,1-6H3/q+4

6 October 2016

Identifiers

InChI

1 reference

ZINC87515704 (English)

OUIWRUVXYIBBQY-UHFFFAOYSA-N

6 October 2016

InChIKey

2 references

ZINC87515704 (English)

6 October 2016

stated in

ChEBI release 2020-09-01

1 reference

2,2'-{1,3-Propanediylbis[(dimethylammonio)-3,1-propanediyl-1-pyridinyl-4-ylidenemethylylidene]}bis(3-methyl-1,3-benzothiazol-3-ium) (English)

6 October 2016

1 reference

ZINC87515704 (English)

6 October 2016

ChEBI ID

52802

mapping relation type

1 reference

BoBo-1(4+) (English)