Vitas-M small molecule compound
methyl 2-{[(2E)-2-cyano-3-(naphthalen-1-yl)prop-2-enoyl]amino}-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STK949547
SMILES N#C/C(=C\c1cccc2c1cccc2)/C(=O)Nc1sc(c(c1C(=O)OC)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 C22H18N2O3S MW 390.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O3S/c1-13-14(2)28-21(19(13)22(26)27-3)24-20(25)17(12-23)11-16-9-6-8-15-7-4-5-10-18(15)16/h4-11H,1-3H3,(H,24,25)/b17-11+InChIKey
YQUCBEJMMSGIJT-GZTJUZNOSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=O)C(=CC2=CC=CC3=CC=CC=C32)C#N)C
InChI=1SC22H18N2O3Sc11314(2)2821(19(13)22(26)273)2420(25)17(1223)1116968157451018(15)16h411H13H3(H2425)b1711+
methyl2(((2E)2cyano3(naphthalen1yl)prop2enoyl)amino)45dimethylthiophene3carboxylate
METHYL2(((E)2CYANO3NAPHTHALEN1YLPROP2ENOYL)AMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
METHYL2((2E)2CYANO3NAPHTHYLPROP2ENOYLAMINO)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD04193528
N#CC(=Cc1cccc2c1cccc2)C(=O)Nc1sc(c(c1C(=O)OC)C)C
ZINC000001453550
ZINC01453550
ZINC1453550
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