Vitas-M small molecule compound
(2Z)-3-{2-[(2-chloro-6-fluorobenzyl)oxy]-3-methoxyphenyl}-2-[(4-chlorophenyl)sulfonyl]prop-2-enenitrile
Catalog ID
STK408859
SMILES COc1cccc(c1OCc1c(F)cccc1Cl)/C=C(\S(=O)(=O)c1ccc(cc1)Cl)/C#N
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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 C23H16Cl2FNO4S MW 492.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16Cl2FNO4S/c1-30-22-7-2-4-15(23(22)31-14-19-20(25)5-3-6-21(19)26)12-18(13-27)32(28,29)17-10-8-16(24)9-11-17/h2-12H,14H2,1H3/b18-12-InChIKey
RKVIJFQAFPQLLR-PDGQHHTCSA-NSynonyms
(2Z)3(2((2chloro6fluorobenzyl)oxy)3methoxyphenyl)2((4chlorophenyl)sulfonyl)prop2enenitrile
(Z)3(2((2CHLORO6FLUOROPHENYL)METHOXY)3METHOXYPHENYL)2(4CHLOROPHENYL)SULFONYLPROP2ENENITRILE
COC1=CC=CC(=C1OCC2=C(C=CC=C2Cl)F)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)Cl
COc1cccc(c1OCc1c(F)cccc1Cl)C=C(S(=O)(=O)c1ccc(cc1)Cl)C#N
InChI=1SC23H16Cl2FNO4Sc1302272415(23(22)31141920(25)53621(19)26)1218(1327)32(2829)1710816(24)91117h212H14H21H3b1812
MFCD07625518
ZINC000032561918
ZINC32561918
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