Vitas-M small molecule compound

2-methyl-N-{2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}-5-nitrobenzenesulfonamide

Catalog ID
STK769891
SMILES Cc1ccc(cc1S(=O)(=O)NCCc1c(C)[nH]c2c1cc(cc2)OC(F)(F)F)[N+](=O)[O-]

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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 C19H18F3N3O5S MW 457.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18F3N3O5S/c1-11-3-4-13(25(26)27)9-18(11)31(28,29)23-8-7-15-12(2)24-17-6-5-14(10-16(15)17)30-19(20,21)22/h3-6,9-10,23-24H,7-8H2,1-2H3
InChIKey
DZCZGCBUQMQNIL-UHFFFAOYSA-N
Synonyms
681844-06-4
2methylN(2(2methyl5(trifluoromethoxy)1Hindol3yl)ethyl)5nitrobenzenesulfonamide
681844064
CC1=C(C=C(C=C1)(N+)(=O)(O))S(=O)(=O)NCCC2=C(NC3=C2C=C(C=C3)OC(F)(F)F)C
Cc1ccc(cc1S(=O)(=O)NCCc1c(C)(nH)c2c1cc(cc2)OC(F)(F)F)(N+)(=O)(O)
InChI=1SC19H18F3N3O5Sc1113413(25(26)27)918(11)31(2829)23871512(2)24176514(1016(15)17)3019(2021)22h369102324H78H212H3
MFCD03763799
ZINC000008868309
ZINC08868309
ZINC8868309

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Available files

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