Vitas-M small molecule compound
(2Z)-3-methyl-4-oxo-4-{[4-(pyrrolidin-1-ylsulfonyl)phenyl]amino}but-2-enoic acid
Catalog ID
STK409383
SMILES O=C(/C(=C\C(=O)O)/C)Nc1ccc(cc1)S(=O)(=O)N1CCCC1
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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 C15H18N2O5S MW 338.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O5S/c1-11(10-14(18)19)15(20)16-12-4-6-13(7-5-12)23(21,22)17-8-2-3-9-17/h4-7,10H,2-3,8-9H2,1H3,(H,16,20)(H,18,19)/b11-10-InChIKey
CRJVUTXZPURHBY-KHPPLWFESA-NSynonyms
(2Z)3(N(4(PYRROLIDINYLSULFONYL)PHENYL)CARBAMOYL)BUT2ENOICACID
(2Z)3methyl4oxo4((4(pyrrolidin1ylsulfonyl)phenyl)amino)but2enoicacid
(Z)3methyl4oxo4(4pyrrolidin1ylsulfonylanilino)but2enoicacid
CC(=CC(=O)O)C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2
InChI=1SC15H18N2O5Sc111(1014(18)19)15(20)16124613(7512)23(2122)17823917h4710H2389H21H3(H1620)(H1819)b1110
MFCD09761942
O=C(C(=CC(=O)O)C)Nc1ccc(cc1)S(=O)(=O)N1CCCC1
ZINC000011566396
ZINC11566396
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