Vitas-M small molecule compound
methyl 5-carbamoyl-2-({(2E)-2-cyano-3-[5-(dimethylamino)furan-2-yl]prop-2-enoyl}amino)-4-methylthiophene-3-carboxylate
Catalog ID
STK434262
SMILES N#C/C(=C\c1ccc(o1)N(C)C)/C(=O)Nc1sc(c(c1C(=O)OC)C)C(=O)N
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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 C18H18N4O5S MW 402.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O5S/c1-9-13(18(25)26-4)17(28-14(9)15(20)23)21-16(24)10(8-19)7-11-5-6-12(27-11)22(2)3/h5-7H,1-4H3,(H2,20,23)(H,21,24)/b10-7+InChIKey
FYQYZWMZOCBAEQ-JXMROGBWSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=O)C(=CC2=CC=C(O2)N(C)C)C#N)C(=O)N
InChI=1SC18H18N4O5Sc1913(18(25)264)17(2814(9)15(20)23)2116(24)10(819)7115612(2711)22(2)3h57H14H3(H22023)(H2124)b107+
METHYL2((2E)3(5(DIMETHYLAMINO)(2FURYL))2CYANOPROP2ENOYLAMINO)5CARBAMOYL4METHYLTHIOPHENE3CARBOXYLATE
methyl5carbamoyl2(((2E)2cyano3(5(dimethylamino)furan2yl)prop2enoyl)amino)4methylthiophene3carboxylate
METHYL5CARBAMOYL2(((E)2CYANO3(5(DIMETHYLAMINO)FURAN2YL)PROP2ENOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03942950
N#CC(=Cc1ccc(o1)N(C)C)C(=O)Nc1sc(c(c1C(=O)OC)C)C(=O)N
ZINC000006825032
ZINC06825032
ZINC6825032
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.