Vitas-M small molecule compound

(2E)-3-[1-(4-chlorobenzyl)-2-methyl-1H-indol-3-yl]-2-cyano-N-(3-ethoxyphenyl)prop-2-enamide

Catalog ID
STK183240
SMILES CCOc1cccc(c1)NC(=O)/C(=C/c1c(C)n(c2c1cccc2)Cc1ccc(cc1)Cl)/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 C28H24ClN3O2 MW 469.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24ClN3O2/c1-3-34-24-8-6-7-23(16-24)31-28(33)21(17-30)15-26-19(2)32(27-10-5-4-9-25(26)27)18-20-11-13-22(29)14-12-20/h4-16H,3,18H2,1-2H3,(H,31,33)/b21-15+
InChIKey
URJUEXMAFHYPGR-RCCKNPSSSA-N
Synonyms

(2E)3(1((4CHLOROPHENYL)METHYL)2METHYLINDOL3YL)2CYANON(3ETHOXYPHENYL)PROP2ENAMIDE
(2E)3(1(4CHLOROBENZYL)2METHYL1HINDOL3YL)2CYANON(3ETHOXYPHENYL)PROP2ENAMIDE
(E)3(1((4CHLOROPHENYL)METHYL)2METHYLINDOL3YL)2CYANON(3ETHOXYPHENYL)PROP2ENAMIDE
(E)3(1(4chlorobenzyl)2methyl1Hindol3yl)2cyanoN(3ethoxyphenyl)acrylamide
CCOC1=CC=CC(=C1)NC(=O)C(=CC2=C(N(C3=CC=CC=C32)CC4=CC=C(C=C4)Cl)C)C#N
CCOc1cccc(c1)NC(=O)C(=Cc1c(C)n(c2c1cccc2)Cc1ccc(cc1)Cl)C#N
InChI=1SC28H24ClN3O2c13342486723(1624)3128(33)21(1730)152619(2)32(271054925(26)27)1820111322(29)141220h416H318H212H3(H3133)b2115+
MFCD02194037
ZINC000002305881
ZINC02305881
ZINC2305881

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Available files

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