Vitas-M small molecule compound
(2Z)-3-(4-nitrophenyl)-2-(phenylsulfonyl)-N-(pyridin-3-ylmethyl)prop-2-enamide
Catalog ID
STK701956
SMILES O=C(/C(=C/c1ccc(cc1)[N+](=O)[O-])/S(=O)(=O)c1ccccc1)NCc1cccnc1
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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 C21H17N3O5S MW 423.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O5S/c25-21(23-15-17-5-4-12-22-14-17)20(30(28,29)19-6-2-1-3-7-19)13-16-8-10-18(11-9-16)24(26)27/h1-14H,15H2,(H,23,25)/b20-13-InChIKey
SJKADCDMPOHNIE-MOSHPQCFSA-NSynonyms
(2Z)3(4nitrophenyl)2(phenylsulfonyl)N(pyridin3ylmethyl)prop2enamide
(Z)2(benzenesulfonyl)3(4nitrophenyl)N(pyridin3ylmethyl)prop2enamide
C1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC=C(C=C2)(N+)(=O)(O))C(=O)NCC3=CN=CC=C3
InChI=1SC21H17N3O5Sc2521(2315175412221417)20(30(2829)196213719)131681018(11916)24(26)27h114H15H2(H2325)b2013
MFCD03461715
O=C(C(=Cc1ccc(cc1)(N+)(=O)(O))S(=O)(=O)c1ccccc1)NCc1cccnc1
ZINC000032675376
ZINC32675376
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