Vitas-M small molecule compound
2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carbonitrile
Catalog ID
STK441377
SMILES N#Cc1c(sc2c1CCCCCC2)N1C(=O)C2C(C1=O)C1CC2C=C1
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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 C20H20N2O2S MW 352.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O2S/c21-10-14-13-5-3-1-2-4-6-15(13)25-20(14)22-18(23)16-11-7-8-12(9-11)17(16)19(22)24/h7-8,11-12,16-17H,1-6,9H2InChIKey
SNDXLDVKDKFFHO-UHFFFAOYSA-NSynonyms
2(13dioxo133a477ahexahydro2H47methanoisoindol2yl)456789hexahydrocycloocta(b)thiophene3carbonitrile
C1CCCC2=C(CC1)C(=C(S2)N3C(=O)C4C5CC(C4C3=O)C=C5)C#N
InChI=1SC20H20N2O2Sc2110141353124615(13)2520(14)2218(23)16117812(911)17(16)19(22)24h7811121617H169H2
MFCD03900482
ZINC000102233394
ZINC000102608497
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