Terminology Service for NFDI4Health
PK-11195
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http://purl.obolibrary.org/obo/CHEBI_73290
A monocarboxylic acid amide obtained by formal condensation of the carboxy group of 1-(2-chlorophenyl)isoquinoline-3-carboxylic acid with the amino group of sec-butylmethylamine
Term info
Label
PK-11195
Synonyms
- N-sec-butyl-1-(2-chlorophenyl)-N-methylisoquinoline-3-carboxamide
Subsets
3_STAR
charge
0
formula
C21H21ClN2O
has obo namespace
chebi_ontology
has related synonym
1-(2-Chlorophenyl)-N-methyl-N-(1-methylpropyl)-3-isoquinolinecarboxamide, PK11195, RP 52028
id
CHEBI:73290
inchi
InChI=1S/C21H21ClN2O/c1-4-14(2)24(3)21(25)19-13-15-9-5-6-10-16(15)20(23-19)17-11-7-8-12-18(17)22/h5-14H,4H2,1-3H3
inchikey
RAVIZVQZGXBOQO-UHFFFAOYSA-N
mass
352.85700
monoisotopicmass
352.13424
smiles
CCC(C)N(C)C(=O)c1cc2ccccc2c(n1)-c1ccccc1Cl