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ChEBI
> Main
CHEBI:70706 - vilazodone(1+)
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ChEBI Name
vilazodone(1+)
ChEBI ID
CHEBI:70706
Definition
An organic cation that is the conjugate acid of vilazodone.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
No supplier information found for this compound.
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Molfile
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Molfile
Formula
C26H28N5O2
Net Charge
+1
Average Mass
442.53280
Monoisotopic Mass
442.22375
InChI
InChI=1S/C26H27N5O2/c27-
16-
18-
4-
6-
23-
22(13-
18)
19(17-
29-
23)
3-
1-
2-
8-
30-
9-
11-
31(12-
10-
30)
21-
5-
7-
24-
20(14-
21)
15-
25(33-
24)
26(28)
32/h4-
7,13-
15,17,29H,1-
3,8-
12H2,(H2,28,32)
/p+1
InChIKey
SGEGOXDYSFKCPT-UHFFFAOYSA-O
SMILES
NC(=O)c1cc2cc(ccc2o1)N1CC[NH+](CCCCc2c[nH]c3ccc(cc23)C#N)CC1
ChEBI Ontology
Outgoing
vilazodone(1+) (
CHEBI:70706
)
is a
organic cation (
CHEBI:25697
)
vilazodone(1+) (
CHEBI:70706
)
is conjugate acid of
vilazodone (
CHEBI:70707
)
Incoming
vilazodone hydrochloride (
CHEBI:70705
)
has part
vilazodone(1+) (
CHEBI:70706
)
vilazodone (
CHEBI:70707
)
is conjugate base of
vilazodone(1+) (
CHEBI:70706
)
IUPAC Name
4-(2-carbamoyl-1-benzofuran-5-yl)-1-[4-(5-cyano-1
H
-indol-3-yl)butyl]piperazin-1-ium
Synonym
Source
vilazodone cation
ChEBI
Last Modified
15 November 2012