Vitas-M small molecule compound

N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-2,6-difluorobenzamide

Catalog ID
STK452539
SMILES N#Cc1c(sc2c1CCCCCC2)NC(=O)c1c(F)cccc1F

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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 C18H16F2N2OS MW 346.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16F2N2OS/c19-13-7-5-8-14(20)16(13)17(23)22-18-12(10-21)11-6-3-1-2-4-9-15(11)24-18/h5,7-8H,1-4,6,9H2,(H,22,23)
InChIKey
IYUUEUMPIYKCRK-UHFFFAOYSA-N
Synonyms

C1CCCC2=C(CC1)C(=C(S2)NC(=O)C3=C(C=CC=C3F)F)C#N
InChI=1SC18H16F2N2OSc191375814(20)16(13)17(23)221812(1021)1163124915(11)2418h578H1469H2(H2223)
MFCD02607734
N(3cyano456789hexahydrocycloocta(b)thiophen2yl)26difluorobenzamide
ZINC000000371636
ZINC00371636
ZINC371636

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Available files

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