Vitas-M small molecule compound
ethyl 2-{[1-(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)ethyl]amino}-4-(2-methylpropyl)thiophene-3-carboxylate
Catalog ID
STL328084
SMILES CCOC(=O)c1c(scc1CC(C)C)N/C(=C/1\C(=O)c2c(C1=O)cccc2)/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 C22H23NO4S MW 397.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO4S/c1-5-27-22(26)18-14(10-12(2)3)11-28-21(18)23-13(4)17-19(24)15-8-6-7-9-16(15)20(17)25/h6-9,11-12,23H,5,10H2,1-4H3InChIKey
LWZODKYFQSCEIM-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC=C1CC(C)C)NC(=C2C(=O)C3=CC=CC=C3C2=O)C
CCOC(=O)c1c(scc1CC(C)C)NC(=C1C(=O)c2c(C1=O)cccc2)C
ethyl2((1(13dioxo13dihydro2Hinden2ylidene)ethyl)amino)4(2methylpropyl)thiophene3carboxylate
ethyl2((1(13dioxo1Hinden2(3H)ylidene)ethyl)amino)4isobutylthiophene3carboxylate
ETHYL2(1(13DIOXOINDEN2YLIDENE)ETHYLAMINO)4(2METHYLPROPYL)THIOPHENE3CARBOXYLATE
InChI=1SC22H23NO4Sc152722(26)1814(1012(2)3)112821(18)2313(4)1719(24)15867916(15)20(17)25h69111223H510H214H3
MFCD01958337
ZINC000002287500
ZINC02287500
ZINC2287500
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