Vitas-M small molecule compound
5-{[(2E)-3-(5-chlorothiophen-2-yl)-2-cyanoprop-2-enoyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide
Catalog ID
STK443916
SMILES N#C/C(=C\c1ccc(s1)Cl)/C(=O)Nc1sc(c(c1C#N)C)C(=O)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 C17H13ClN4O2S2 MW 404.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN4O2S2/c1-9-12(8-20)16(26-14(9)17(24)22(2)3)21-15(23)10(7-19)6-11-4-5-13(18)25-11/h4-6H,1-3H3,(H,21,23)/b10-6+InChIKey
QPRHAYICDOKLHK-UXBLZVDNSA-NSynonyms
(2E)N(5(NNDIMETHYLCARBAMOYL)3CYANO4METHYL(2THIENYL))3(5CHLORO(2THIENYL))2CYANOPROP2ENAMIDE
5(((2E)3(5chlorothiophen2yl)2cyanoprop2enoyl)amino)4cyanoNN3trimethylthiophene2carboxamide
5(((E)3(5chlorothiophen2yl)2cyanoprop2enoyl)amino)4cyanoNN3trimethylthiophene2carboxamide
CC1=C(SC(=C1C#N)NC(=O)C(=CC2=CC=C(S2)Cl)C#N)C(=O)N(C)C
InChI=1SC17H13ClN4O2S2c1912(820)16(2614(9)17(24)22(2)3)2115(23)10(719)6114513(18)2511h46H13H3(H2123)b106+
MFCD04055107
N#CC(=Cc1ccc(s1)Cl)C(=O)Nc1sc(c(c1C#N)C)C(=O)N(C)C
ZINC000006526985
ZINC06526985
ZINC6526985
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