CHEBI:107626 - N-[(2S)-1-(1H-benzimidazol-2-ylamino)-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[(2S)-1-(1H-benzimidazol-2-ylamino)-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide
ChEBI ID CHEBI:107626
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H22N4O2
Net Charge 0
Average Mass 350.415
Monoisotopic Mass 350.17428
InChI InChI=1S/C20H22N4O2/c1-12(2)17(23-18(25)14-8-6-7-13(3)11-14)19(26)24-20-21-15-9-4-5-10-16(15)22-20/h4-12,17H,1-3H3,(H,23,25)(H2,21,22,24,26)/t17-/m0/s1
InChIKey SIFAUQMIWOPROB-KRWDZBQOSA-N
SMILES CC1=CC=CC(=C1)C(=O)N[C@@H](C(C)C)C(=O)NC2=NC3=CC=CC=C3N2
ChEBI Ontology
Outgoing N-[(2S)-1-(1H-benzimidazol-2-ylamino)-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide (CHEBI:107626) is a secondary carboxamide (CHEBI:140325)
Manual Xref Database
LSM-18982 LINCS
View more database links
Last Modified
12 March 2018