Vitas-M small molecule compound
N-{2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-2-ethoxybenzamide
Catalog ID
STK527815
SMILES CCOc1ccccc1C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1sc2c(c1C#N)CCCCC2
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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 C22H21F6N3O2S MW 505.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21F6N3O2S/c1-2-33-16-10-7-6-9-14(16)18(32)30-20(21(23,24)25,22(26,27)28)31-19-15(12-29)13-8-4-3-5-11-17(13)34-19/h6-7,9-10,31H,2-5,8,11H2,1H3,(H,30,32)InChIKey
CUVKSSKQUXIZEF-UHFFFAOYSA-NSynonyms
361989-40-4361989404
CCOC1=CC=CC=C1C(=O)NC(C(F)(F)F)(C(F)(F)F)NC2=C(C3=C(S2)CCCCC3)C#N
InChI=1SC22H21F6N3O2Sc1233161076914(16)18(32)3020(21(2324)2522(2627)28)311915(1229)1384351117(13)3419h6791031H25811H21H3(H3032)
MFCD01954259
N(2((3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)amino)111333hexafluoropropan2yl)2ethoxybenzamide
ZINC000002286995
ZINC02286995
ZINC2286995
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