Vitas-M small molecule compound
methyl (3-{(1E)-2-cyano-3-[(4-methoxyphenyl)amino]-3-oxoprop-1-en-1-yl}-1H-indol-1-yl)acetate
Catalog ID
STL363647
SMILES COC(=O)Cn1cc(c2c1cccc2)/C=C(/C(=O)Nc1ccc(cc1)OC)\C#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 C22H19N3O4 MW 389.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O4/c1-28-18-9-7-17(8-10-18)24-22(27)15(12-23)11-16-13-25(14-21(26)29-2)20-6-4-3-5-19(16)20/h3-11,13H,14H2,1-2H3,(H,24,27)/b15-11+InChIKey
IKQRNXPVFFFEFN-RVDMUPIBSA-NSynonyms
(E)methyl2(3(2cyano3((4methoxyphenyl)amino)3oxoprop1en1yl)1Hindol1yl)acetate
COC(=O)Cn1cc(c2c1cccc2)C=C(C(=O)Nc1ccc(cc1)OC)C#N
COC1=CC=C(C=C1)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)OC)C#N
InChI=1SC22H19N3O4c128189717(81018)2422(27)15(1223)11161325(1421(26)292)20643519(16)20h31113H14H212H3(H2427)b1511+
methyl(3((1E)2cyano3((4methoxyphenyl)amino)3oxoprop1en1yl)1Hindol1yl)acetate
METHYL2(3((E)2CYANO3(4METHOXYANILINO)3OXOPROP1ENYL)INDOL1YL)ACETATE
MFCD02904876
ZINC000000871916
ZINC00871916
ZINC871916
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