Vitas-M small molecule compound

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

Catalog ID
STK418632
SMILES N#Cc1c(sc2c1CCCCCC2)NC(=O)C1c2ccccc2Oc2c1cccc2

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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 C25H22N2O2S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O2S/c26-15-19-16-9-3-1-2-4-14-22(16)30-25(19)27-24(28)23-17-10-5-7-12-20(17)29-21-13-8-6-11-18(21)23/h5-8,10-13,23H,1-4,9,14H2,(H,27,28)
InChIKey
KSYLZDWLEXBYQD-UHFFFAOYSA-N
Synonyms
353766-65-1
353766651
C1CCCC2=C(CC1)C(=C(S2)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35)C#N
InChI=1SC25H22N2O2Sc26151916931241422(16)3025(19)2724(28)231710571220(17)292113861118(21)23h58101323H14914H2(H2728)
MFCD01648162
N(3cyano456789hexahydrocycloocta(b)thiophen2yl)9Hxanthene9carboxamide
ZINC000002745585
ZINC02745585
ZINC2745585

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Available files

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