Vitas-M small molecule compound
(2E)-N-{2-[(2-fluorobenzyl)sulfanyl]ethyl}-3-(4-nitrophenyl)prop-2-enamide
Catalog ID
STL288311
SMILES O=C(/C=C/c1ccc(cc1)[N+](=O)[O-])NCCSCc1ccccc1F
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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 C18H17FN2O3S MW 360.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17FN2O3S/c19-17-4-2-1-3-15(17)13-25-12-11-20-18(22)10-7-14-5-8-16(9-6-14)21(23)24/h1-10H,11-13H2,(H,20,22)/b10-7+InChIKey
CAEZANOWSYQSMY-JXMROGBWSA-NSynonyms
(2E)N(2((2fluorobenzyl)sulfanyl)ethyl)3(4nitrophenyl)prop2enamide
(E)N(2((2fluorophenyl)methylsulfanyl)ethyl)3(4nitrophenyl)prop2enamide
C1=CC=C(C(=C1)CSCCNC(=O)C=CC2=CC=C(C=C2)(N+)(=O)(O))F
InChI=1SC18H17FN2O3Sc1917421315(17)132512112018(22)107145816(9614)21(23)24h110H1113H2(H2022)b107+
MFCD09680021
O=C(C=Cc1ccc(cc1)(N+)(=O)(O))NCCSCc1ccccc1F
ZINC000013672302
ZINC13672302
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