Vitas-M small molecule compound
1-[(1Z)-3-(azepan-1-yl)-1-(3-bromophenyl)-3-oxoprop-1-en-2-yl]pyridin-2(1H)-one
Catalog ID
STK037212
SMILES Brc1cccc(c1)/C=C(\n1ccccc1=O)/C(=O)N1CCCCCC1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H21BrN2O2 MW 401.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21BrN2O2/c21-17-9-7-8-16(14-17)15-18(23-13-6-3-10-19(23)24)20(25)22-11-4-1-2-5-12-22/h3,6-10,13-15H,1-2,4-5,11-12H2/b18-15-InChIKey
BRFYNNSNQLPALI-SDXDJHTJSA-NSynonyms
1((1Z)3(AZEPAN1YL)1(3BROMOPHENYL)3OXOPROP1EN2YL)PYRIDIN2(1H)ONE
1((Z)3(AZEPAN1YL)1(3BROMOPHENYL)3OXOPROP1EN2YL)PYRIDIN2ONE
Brc1cccc(c1)C=C(n1ccccc1=O)C(=O)N1CCCCCC1
C1CCCN(CC1)C(=O)C(=CC2=CC(=CC=C2)Br)N3C=CC=CC3=O
InChI=1SC20H21BrN2O2c211797816(1417)1518(2313631019(23)24)20(25)221141251222h36101315H12451112H2b1815
MFCD08050514
STK037212
ZINC000004615942
ZINC04615942
ZINC4615942
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