Vitas-M small molecule compound

2-[(E)-2-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethenyl]-3-methylquinazolin-4(3H)-one

Catalog ID
STK019275
SMILES COc1ccc2c(c1)c(/C=C/c1nc3ccccc3c(=O)n1C)c(n2C)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 C22H21N3O2 MW 359.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O2/c1-14-16(18-13-15(27-4)9-11-20(18)24(14)2)10-12-21-23-19-8-6-5-7-17(19)22(26)25(21)3/h5-13H,1-4H3/b12-10+
InChIKey
RJLHERBVQQIVFM-ZRDIBKRKSA-N
Synonyms

(E)2(2(5methoxy12dimethyl1Hindol3yl)vinyl)3methylquinazolin4(3H)one
2((1E)2(5METHOXY12DIMETHYLINDOL3YL)VINYL)3METHYL3HYDROQUINAZOLIN4ONE
2((E)2(5METHOXY12DIMETHYL1HINDOL3YL)ETHENYL)3METHYLQUINAZOLIN4(3H)ONE
2((E)2(5METHOXY12DIMETHYLINDOL3YL)ETHENYL)3METHYLQUINAZOLIN4ONE
2(2(5METHOXY12DIMETHYL1HINDOL3YL)VINYL)3METHYL3HQUINAZOLIN4ONE
2(2(5METHOXY12DIMETHYL1HINDOL3YL)VINYL)3METHYL4(3H)QUINAZOLINONE
CC1=C(C2=C(N1C)C=CC(=C2)OC)C=CC3=NC4=CC=CC=C4C(=O)N3C
COc1ccc2c(c1)c(C=Cc1nc3ccccc3c(=O)n1C)c(n2C)C
InChI=1SC22H21N3O2c11416(181315(274)91120(18)24(14)2)1012212319865717(19)22(26)25(21)3h513H14H3b1210+
MFCD01242527
STK019275
ZINC000003894045
ZINC03894045
ZINC3894045

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.