Vitas-M small molecule compound

N-{(1E)-3-(azepan-1-yl)-1-[4-(dimethylamino)phenyl]-3-oxoprop-1-en-2-yl}benzamide

Catalog ID
STK832057
SMILES CN(c1ccc(cc1)/C=C(\C(=O)N1CCCCCC1)/NC(=O)c1ccccc1)C

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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 C24H29N3O2 MW 391.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O2/c1-26(2)21-14-12-19(13-15-21)18-22(24(29)27-16-8-3-4-9-17-27)25-23(28)20-10-6-5-7-11-20/h5-7,10-15,18H,3-4,8-9,16-17H2,1-2H3,(H,25,28)/b22-18+
InChIKey
NMOSKSWYOZEEAR-RELWKKBWSA-N
Synonyms

(Z)N(3(azepan1yl)1(4(dimethylamino)phenyl)3oxoprop1en2yl)benzamide
CN(C)C1=CC=C(C=C1)C=C(C(=O)N2CCCCCC2)NC(=O)C3=CC=CC=C3
CN(c1ccc(cc1)C=C(C(=O)N1CCCCCC1)NC(=O)c1ccccc1)C
InChI=1SC24H29N3O2c126(2)21141219(131521)1822(24(29)271683491727)2523(28)20106571120h57101518H34891617H212H3(H2528)b2218+
MFCD00336775
N((1E)3(azepan1yl)1(4(dimethylamino)phenyl)3oxoprop1en2yl)benzamide
N((E)3(azepan1yl)1(4(dimethylamino)phenyl)3oxoprop1en2yl)benzamide
N((E)3(AZEPAN1YL)1(4DIMETHYLAMINOPHENYL)3OXOPROP1EN2YL)BENZAMIDE
N(1(1AZEPANYLCARBONYL)2(4(DIMETHYLAMINO)PHENYL)VINYL)BENZAMIDE
N(1(AZEPANE1CARBONYL)2(4DIMETHYLAMINOPHENYL)VINYL)BENZAMIDE
ZINC000000674550
ZINC00674550
ZINC674550

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.