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CHEBI:41577 - 1-(3-CARBAMIMIDOYL-BENZYL)-4-METHYL-1H-INDOLE-2-CARBOXYLIC ACID 3,5-DIMETHYL-BENZYLAMIDE

Default Structure
ChEBI IDCHEBI:41577
ChEBI Name1-(3-CARBAMIMIDOYL-BENZYL)-4-METHYL-1H-INDOLE-2-CARBOXYLIC ACID 3,5-DIMETHYL-BENZYLAMIDE
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC27H28N4O
Net Charge0
Average Mass424.548
Monoisotopic Mass424.22631
SMILES[H]/N=C(/c1c([H])c([H])c([H])c(C([H])([H])n2c(C(=O)N([H])C([H])([H])c3c([H])c(C([H])([H])[H])c([H])c(C([H])([H])[H])c3[H])c([H])c3c(C([H])([H])[H])c([H])c([H])c([H])c32)c1[H])N([H])[H]
InChIInChI=1S/C27H28N4O/c1-17-10-18(2)12-21(11-17)15-30-27(32)25-14-23-19(3)6-4-9-24(23)31(25)16-20-7-5-8-22(13-20)26(28)29/h4-14H,15-16H2,1-3H3,(H3,28,29)(H,30,32)
InChIKeyJSQZLEYFOOSZPU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-(3-CARBAMIMIDOYL-BENZYL)-4-METHYL-1H-INDOLE-2-CARBOXYLIC ACID 3,5-DIMETHYL-BENZYLAMIDE (CHEBI:41577) is a unclassifieds (CHEBI:27189)
Synonyms  Source
1-(3-CARBAMIMIDOYL-BENZYL)-4-METHYL-1H-INDOLE-2-CARBOXYLIC ACID 3,5-DIMETHYL-BENZYLAMIDEPDBeChem
1-(3-carbamimidoylbenzyl)-N-(3,5-dimethylbenzyl)-4-methyl-1H-indole-2-carboxamidePDBeChem
Manual XrefsDatabases
CMIPDBeChem