Vitas-M small molecule compound
methyl 2-{[(E)-2-cyano-2-(4-phenyl-1,3-thiazol-2-yl)ethenyl]amino}-4,5-dimethoxybenzoate
Catalog ID
STK537397
SMILES N#C/C(=C\Nc1cc(OC)c(cc1C(=O)OC)OC)/c1scc(n1)c1ccccc1
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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 C22H19N3O4S MW 421.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O4S/c1-27-19-9-16(22(26)29-3)17(10-20(19)28-2)24-12-15(11-23)21-25-18(13-30-21)14-7-5-4-6-8-14/h4-10,12-13,24H,1-3H3/b15-12+InChIKey
VJPGESLVNMAVJV-NTCAYCPXSA-NSynonyms
(E)methyl2((2cyano2(4phenylthiazol2yl)vinyl)amino)45dimethoxybenzoate
COC1=C(C=C(C(=C1)C(=O)OC)NC=C(C#N)C2=NC(=CS2)C3=CC=CC=C3)OC
InChI=1SC22H19N3O4Sc12719916(22(26)293)17(1020(19)282)241215(1123)212518(133021)147546814h410121324H13H3b1512+
methyl2(((E)2cyano2(4phenyl13thiazol2yl)ethenyl)amino)45dimethoxybenzoate
MFCD02983112
N#CC(=CNc1cc(OC)c(cc1C(=O)OC)OC)c1scc(n1)c1ccccc1
ZINC000001835905
ZINC01835905
ZINC1835905
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