butoconazole(1+) (Q27130947)

butoconazole cation (English)

7 October 2016

chemical formula

C₁₉H₁₈Cl₃N₂S⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

[H+].C1=CC(=C(C(=C1)Cl)SC(CCC2=CC=C(C=C2)Cl)CN3C=CN=C3)Cl

1 reference

butoconazole cation (English)

InChI=1S/C19H17Cl3N2S/c20-15-7-4-14(5-8-15)6-9-16(12-24-11-10-23-13-24)25-19-17(21)2-1-3-18(19)22/h1-5,7-8,10-11,13,16H,6,9,12H2/p+1

7 October 2016

Identifiers

InChI

1 reference

butoconazole cation (English)

SWLMUYACZKCSHZ-UHFFFAOYSA-O

7 October 2016

InChIKey

2 references

butoconazole cation (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

1H-Imidazole, 1-[4-(4-chlorophenyl)-2-[(2,6-dichlorophenyl)thio]butyl]-, hydrogen salt (English)

7 October 2016

2 references

butoconazole cation (English)

matched by identifier from

7 October 2016

InChIKey

SWLMUYACZKCSHZ-UHFFFAOYSA-O

141501764

1 reference

matched by identifier from

InChIKey

SWLMUYACZKCSHZ-UHFFFAOYSA-O

ChEBI ID

61263

mapping relation type

2 references

butoconazole(1+) (English)