N-(6-chloro-7-ethylsulfanyl-9H-beta-carbolin-8-yl)-2-methyl-nicotinamide

HCID 11280944
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Basic information

Standard SMILES
CCSc1c(Cl)cc2c([nH]c3cnccc32)c1NC(=O)c1cccnc1C
InChIKey
KUBIRPSTEODLSB-UHFFFAOYSA-N
Molecular formula
C20H17ClN4OS
Average molar mass
396.9 g/mol

Names & identifiers

Preferred name
N-(6-chloro-7-ethylsulfanyl-9H-beta-carbolin-8-yl)-2-methyl-nicotinamide
IUPAC
N-(6-chloro-7-ethylsulfanyl-9H-pyrido[3,4-b]indol-8-yl)-2-methylpyridine-3-carboxamide

Names & synonyms

SCHEMBL1798775KUBIRPSTEODLSB-UHFFFAOYSA-NN-(6-chloro-7-ethylsulfanyl-9H-beta-carbolin-8-yl)-2-methyl-nicotinamide

Database identifiers

PubChem CID
11280944

Properties

Computed structural properties

XLogP
4
Topological polar surface area
96 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
27

Related reactions

3 records
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Compound notes

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