(Q105123793)

English

(2R)-N-[(Z)-2-(5-bromo-1H-indol-3-yl)ethenyl]-4-[(2R)-butan-2-yl]-5-oxo-2-propan-2-yl-1H-imidazole-2-carboxamide

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

N-[2-(5-bromo-1H-indol-3-yl)ethenyl]-4-butan-2-yl-5-oxo-2-propan-2-yl-1H-imidazole-2-carboxamide

1 reference

based on heuristic

inferred from SMILES

mass

444.11608814 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(2S)-N-[(1Z)-2-(5-bromo-1H-indol-3-yl)ethenyl]-4-[(2R)-butan-2-yl]-2-isopropyl-5-oxo-1H-imidazole-2-carboximidic acid

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₁H₂₅BrN₄O₂

0 references

canonical SMILES

CCC(C)C1=NC(C(=O)NC=Cc2c[nH]c3ccc(Br)cc23)(C(C)C)NC1=O

0 references

isomeric SMILES

CC[C@@H](C)C1=N[C@@](C(=O)N/C=C\c2c[nH]c3ccc(Br)cc23)(C(C)C)NC1=O

0 references

found in taxon

Pycnoclavella kottae

1 reference

stated in

Kottamides A-D: novel bioactive imidazolone-containing alkaloids from the New Zealand ascidian Pycnoclavella kottae.

Identifiers

InChI

InChI=1S/C21H25BrN4O2/c1-5-13(4)18-19(27)26-21(25-18,12(2)3)20(28)23-9-8-14-11-24-17-7-6-15(22)10-16(14)17/h6-13,24H,5H2,1-4H3,(H,23,28)(H,26,27)/b9-8-/t13-,21+/m1/s1

0 references

InChIKey

JAJNSMHHDOZHAF-WRGTULJSSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

JAJNSMHHDOZHAF-WRGTULJSSA-N

(Q105123793)

(2R)-N-[(Z)-2-(5-bromo-1H-indol-3-yl)ethenyl]-4-[(2R)-butan-2-yl]-5-oxo-2-propan-2-yl-1H-imidazole-2-carboxamide

Statements

Identifiers

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