N-(5-tert-Butyl-3-methanesulfonylamino-2-methoxy-phenyl)-3,4-dimethyl-5-(4-pyridin-3-yl-[1,2,3]triazol-1-yl)-benzamide

HCID 21097178

Basic information

Standard SMILES
COc1c(NC(=O)c2cc(C)c(C)c(-n3cc(-c4cccnc4)nn3)c2)cc(C(C)(C)C)cc1NS(C)(=O)=O
InChIKey
UQFDFXGESXKBPV-UHFFFAOYSA-N
Molecular formula
C28H32N6O4S
Average molar mass
548.7 g/mol

Names & identifiers

Preferred name
N-(5-tert-Butyl-3-methanesulfonylamino-2-methoxy-phenyl)-3,4-dimethyl-5-(4-pyridin-3-yl-[1,2,3]triazol-1-yl)-benzamide
IUPAC
N-[5-tert-butyl-3-(methanesulfonamido)-2-methoxyphenyl]-3,4-dimethyl-5-(4-pyridin-3-yltriazol-1-yl)benzamide

Names & synonyms

SCHEMBL4034611UQFDFXGESXKBPV-UHFFFAOYSA-NN-(5-tert-Butyl-3-methanesulfonylamino-2-methoxy-phenyl)-3,4-dimethyl-5-(4-pyridin-3-yl-[1,2,3]triazol-1-yl)-benzamide

Database identifiers

PubChem CID
21097178

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
136 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
8
Heavy atoms
39

Related reactions

3 records

Compound notes

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