Vitas-M small molecule compound
3-chloro-7-nitro-N-[2-(piperidin-1-yl)-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide
Catalog ID
STK254458
SMILES O=C(c1sc2c(c1Cl)cccc2[N+](=O)[O-])Nc1cc(ccc1N1CCCCC1)C(F)(F)F
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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 C21H17ClF3N3O3S MW 483.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClF3N3O3S/c22-17-13-5-4-6-16(28(30)31)18(13)32-19(17)20(29)26-14-11-12(21(23,24)25)7-8-15(14)27-9-2-1-3-10-27/h4-8,11H,1-3,9-10H2,(H,26,29)InChIKey
KYZAASBXAGYRAC-UHFFFAOYSA-NSynonyms
3chloro7nitroN(2(piperidin1yl)5(trifluoromethyl)phenyl)1benzothiophene2carboxamide
3chloro7nitroN(2piperidin1yl5(trifluoromethyl)phenyl)1benzothiophene2carboxamide
C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=C(C4=C(S3)C(=CC=C4)(N+)(=O)(O))Cl
InChI=1SC21H17ClF3N3O3Sc22171354616(28(30)31)18(13)3219(17)20(29)26141112(21(2324)25)7815(14)2792131027h4811H13910H2(H2629)
MFCD05800386
O=C(c1sc2c(c1Cl)cccc2(N+)(=O)(O))Nc1cc(ccc1N1CCCCC1)C(F)(F)F
ZINC000008814652
ZINC08814652
ZINC8814652
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