Vitas-M small molecule compound
N-(3-cyano-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]thiopyran-2-yl)-4-methoxy-3-nitrobenzamide
Catalog ID
STK995799
SMILES N#Cc1c(NC(=O)c2ccc(c(c2)[N+](=O)[O-])OC)sc2c1CC(C)(C)SC2
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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 C18H17N3O4S2 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O4S2/c1-18(2)7-11-12(8-19)17(27-15(11)9-26-18)20-16(22)10-4-5-14(25-3)13(6-10)21(23)24/h4-6H,7,9H2,1-3H3,(H,20,22)InChIKey
QKQCAECMTHETPT-UHFFFAOYSA-NSynonyms
313702-66-8313702668
CC1(CC2=C(CS1)SC(=C2C#N)NC(=O)C3=CC(=C(C=C3)OC)(N+)(=O)(O))C
InChI=1SC18H17N3O4S2c118(2)71112(819)17(2715(11)92618)2016(22)104514(253)13(610)21(23)24h46H79H213H3(H2022)
MFCD01048921
N#Cc1c(NC(=O)c2ccc(c(c2)(N+)(=O)(O))OC)sc2c1CC(C)(C)SC2
N(3cyano55dimethyl47dihydro5Hthieno(23c)thiopyran2yl)4methoxy3nitrobenzamide
N(3CYANO55DIMETHYL47DIHYDROTHIENO(23C)THIOPYRAN2YL)4METHOXY3NITROBENZAMIDE
ZINC000004904871
ZINC04904871
ZINC4904871
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