Vitas-M small molecule compound
methyl (4Z)-1-(2-methoxyethyl)-2-methyl-4-[4-(methylsulfanyl)benzylidene]-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK838504
SMILES COCCN1C(=O)/C(=C\c2ccc(cc2)SC)/C(=C1C)C(=O)OC
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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 C18H21NO4S MW 347.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO4S/c1-12-16(18(21)23-3)15(17(20)19(12)9-10-22-2)11-13-5-7-14(24-4)8-6-13/h5-8,11H,9-10H2,1-4H3/b15-11-InChIKey
IJHCWRHXGLOSAT-PTNGSMBKSA-NSynonyms
(Z)methyl1(2methoxyethyl)2methyl4(4(methylthio)benzylidene)5oxo45dihydro1Hpyrrole3carboxylate
CC1=C(C(=CC2=CC=C(C=C2)SC)C(=O)N1CCOC)C(=O)OC
COCCN1C(=O)C(=Cc2ccc(cc2)SC)C(=C1C)C(=O)OC
InChI=1SC18H21NO4Sc11216(18(21)233)15(17(20)19(12)910222)11135714(244)8613h5811H910H214H3b1511
METHYL(4Z)1(2METHOXYETHYL)2METHYL4((4METHYLSULFANYLPHENYL)METHYLIDENE)5OXOPYRROLE3CARBOXYLATE
methyl(4Z)1(2methoxyethyl)2methyl4(4(methylsulfanyl)benzylidene)5oxo45dihydro1Hpyrrole3carboxylate
MFCD02217701
ZINC000002305293
ZINC02305293
ZINC2305293
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