Vitas-M small molecule compound

N-(azepan-1-ylcarbonothioyl)-3-bromo-4-(hexyloxy)benzamide

Catalog ID
STL065898
SMILES CCCCCCOc1ccc(cc1Br)C(=O)NC(=S)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 C20H29BrN2O2S MW 441.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29BrN2O2S/c1-2-3-4-9-14-25-18-11-10-16(15-17(18)21)19(24)22-20(26)23-12-7-5-6-8-13-23/h10-11,15H,2-9,12-14H2,1H3,(H,22,24,26)
InChIKey
PPHIAWRQYFGSFT-UHFFFAOYSA-N
Synonyms

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)N2CCCCCC2)Br
InChI=1SC20H29BrN2O2Sc12349142518111016(1517(18)21)19(24)2220(26)231275681323h101115H291214H21H3(H222426)
MFCD07168079
N(azepan1ylcarbonothioyl)3bromo4(hexyloxy)benzamide
N(AZEPANE1CARBOTHIOYL)3BROMO4HEXOXYBENZAMIDE
ZINC000012137502
ZINC12137502

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Available files

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