Vitas-M small molecule compound
methyl (4Z)-1-(3,4-dimethylphenyl)-2-methyl-4-[4-(methylsulfanyl)benzylidene]-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK165136
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)SC)c1ccc(c(c1)C)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 C23H23NO3S MW 393.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO3S/c1-14-6-9-18(12-15(14)2)24-16(3)21(23(26)27-4)20(22(24)25)13-17-7-10-19(28-5)11-8-17/h6-13H,1-5H3/b20-13-InChIKey
QOFPAQMHMSSQMG-MOSHPQCFSA-NSynonyms
CC1=C(C=C(C=C1)N2C(=C(C(=CC3=CC=C(C=C3)SC)C2=O)C(=O)OC)C)C
COC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)SC)c1ccc(c(c1)C)C
InChI=1SC23H23NO3Sc1146918(1215(14)2)2416(3)21(23(26)274)20(22(24)25)131771019(285)11817h613H15H3b2013
METHYL(4Z)1(34DIMETHYLPHENYL)2METHYL4((4METHYLSULFANYLPHENYL)METHYLIDENE)5OXOPYRROLE3CARBOXYLATE
METHYL(4Z)1(34DIMETHYLPHENYL)2METHYL4(4(METHYLSULFANYL)BENZYLIDENE)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD03068179
ZINC000004702335
ZINC04702335
ZINC4702335
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