Vitas-M small molecule compound
(2E)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(2-fluorobenzyl)-3-(4-methoxyphenyl)prop-2-enamide
Catalog ID
STK882905
SMILES COc1ccc(cc1)/C=C/C(=O)N(C1CCS(=O)(=O)C1)Cc1ccccc1F
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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 C21H22FNO4S MW 403.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FNO4S/c1-27-19-9-6-16(7-10-19)8-11-21(24)23(18-12-13-28(25,26)15-18)14-17-4-2-3-5-20(17)22/h2-11,18H,12-15H2,1H3/b11-8+InChIKey
UZGKJRZWLITLOR-DHZHZOJOSA-NSynonyms
(2E)N(11dioxidotetrahydrothiophen3yl)N(2fluorobenzyl)3(4methoxyphenyl)prop2enamide
(E)N(11dioxothiolan3yl)N((2fluorophenyl)methyl)3(4methoxyphenyl)prop2enamide
COC1=CC=C(C=C1)C=CC(=O)N(CC2=CC=CC=C2F)C3CCS(=O)(=O)C3
COc1ccc(cc1)C=CC(=O)N(C1CCS(=O)(=O)C1)Cc1ccccc1F
InChI=1SC21H22FNO4Sc127199616(71019)81121(24)23(18121328(2526)1518)1417423520(17)22h21118H1215H21H3b118+
MFCD06646521
ZINC000016750017
ZINC000016750020
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