Vitas-M small molecule compound
(2E)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(3-methoxybenzyl)-3-(4-methylphenyl)prop-2-enamide
Catalog ID
STK882154
SMILES COc1cccc(c1)CN(C1CCS(=O)(=O)C1)C(=O)/C=C/c1ccc(cc1)C
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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 C22H25NO4S MW 399.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25NO4S/c1-17-6-8-18(9-7-17)10-11-22(24)23(20-12-13-28(25,26)16-20)15-19-4-3-5-21(14-19)27-2/h3-11,14,20H,12-13,15-16H2,1-2H3/b11-10+InChIKey
KYWYYLCBHAVYQR-ZHACJKMWSA-NSynonyms
(2E)N(11dioxidotetrahydrothiophen3yl)N(3methoxybenzyl)3(4methylphenyl)prop2enamide
(E)N(11dioxothiolan3yl)N((3methoxyphenyl)methyl)3(4methylphenyl)prop2enamide
CC1=CC=C(C=C1)C=CC(=O)N(CC2=CC(=CC=C2)OC)C3CCS(=O)(=O)C3
COc1cccc(c1)CN(C1CCS(=O)(=O)C1)C(=O)C=Cc1ccc(cc1)C
InChI=1SC22H25NO4Sc1176818(9717)101122(24)23(20121328(2526)1620)151943521(1419)272h3111420H12131516H212H3b1110+
MFCD06646006
ZINC000016742515
ZINC000016742516
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