Vitas-M small molecule compound
methyl (4Z)-2-methyl-1-(3-methylphenyl)-4-[(3-methylthiophen-2-yl)methylidene]-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK326702
SMILES COC(=O)C1=C(C)N(C(=O)/C/1=C\c1sccc1C)c1cccc(c1)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 C20H19NO3S MW 353.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19NO3S/c1-12-6-5-7-15(10-12)21-14(3)18(20(23)24-4)16(19(21)22)11-17-13(2)8-9-25-17/h5-11H,1-4H3/b16-11-InChIKey
SUWQICPBPKLNFK-WJDWOHSUSA-NSynonyms
CC1=CC(=CC=C1)N2C(=C(C(=CC3=C(C=CS3)C)C2=O)C(=O)OC)C
COC(=O)C1=C(C)N(C(=O)C1=Cc1sccc1C)c1cccc(c1)C
InChI=1SC20H19NO3Sc11265715(1012)2114(3)18(20(23)244)16(19(21)22)111713(2)892517h511H14H3b1611
METHYL(4Z)2METHYL1(3METHYLPHENYL)4((3METHYLTHIOPHEN2YL)METHYLIDENE)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
METHYL(4Z)2METHYL1(3METHYLPHENYL)4((3METHYLTHIOPHEN2YL)METHYLIDENE)5OXOPYRROLE3CARBOXYLATE
METHYL2METHYL1(3METHYLPHENYL)4((3METHYL2THIENYL)METHYLENE)5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
MFCD02629792
ZINC000000631861
ZINC00631861
ZINC631861
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