Vitas-M small molecule compound
methyl (2Z)-4-[(3-cyano-4,5-dimethylthiophen-2-yl)amino]-4-oxobut-2-enoate
Catalog ID
STL020841
SMILES COC(=O)/C=C\C(=O)Nc1sc(c(c1C#N)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 C12H12N2O3S MW 264.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O3S/c1-7-8(2)18-12(9(7)6-13)14-10(15)4-5-11(16)17-3/h4-5H,1-3H3,(H,14,15)/b5-4-InChIKey
DZYWBWCEVXVQCU-PLNGDYQASA-NSynonyms
CC1=C(SC(=C1C#N)NC(=O)C=CC(=O)OC)C
COC(=O)C=CC(=O)Nc1sc(c(c1C#N)C)C
InChI=1SC12H12N2O3Sc178(2)1812(9(7)613)1410(15)4511(16)173h45H13H3(H1415)b54
METHYL(2Z)3(N(3CYANO45DIMETHYL(2THIENYL))CARBAMOYL)PROP2ENOATE
methyl(2Z)4((3cyano45dimethylthiophen2yl)amino)4oxobut2enoate
methyl(Z)4((3cyano45dimethylthiophen2yl)amino)4oxobut2enoate
MFCD08547749
ZINC000101130915
ZINC101130915
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