Vitas-M small molecule compound

(5Z)-5-({1-[3-(2,4-dimethylphenoxy)propyl]-1H-indol-3-yl}methylidene)-3-(4-ethylphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione

Catalog ID
STL149167
SMILES CCc1ccc(cc1)N1C(=O)N=C(/C(=C/c2cn(c3c2cccc3)CCCOc2ccc(cc2C)C)/C1=O)O

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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 C32H31N3O4 MW 521.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31N3O4/c1-4-23-11-13-25(14-12-23)35-31(37)27(30(36)33-32(35)38)19-24-20-34(28-9-6-5-8-26(24)28)16-7-17-39-29-15-10-21(2)18-22(29)3/h5-6,8-15,18-20H,4,7,16-17H2,1-3H3,(H,33,36,38)/b27-19-
InChIKey
SITNHSJFYMFBDS-DIBXZPPDSA-N
Synonyms
587009-97-0
(5Z)5((1(3(24dimethylphenoxy)propyl)1Hindol3yl)methylidene)3(4ethylphenyl)6hydroxypyrimidine24(3H5H)dione
(5Z)5((1(3(24DIMETHYLPHENOXY)PROPYL)INDOL3YL)METHYLIDENE)1(4ETHYLPHENYL)13DIAZINANE246TRIONE
587009970
CCC1=CC=C(C=C1)N2C(=O)C(=CC3=CN(C4=CC=CC=C43)CCCOC5=C(C=C(C=C5)C)C)C(=O)NC2=O
CCc1ccc(cc1)N1C(=O)N=C(C(=Cc2cn(c3c2cccc3)CCCOc2ccc(cc2C)C)C1=O)O
InChI=1SC32H31N3O4c1423111325(141223)3531(37)27(30(36)3332(35)38)19242034(28965826(24)28)167173929151021(2)1822(29)3h568151820H471617H213H3(H333638)b2719
MFCD04079741
ZINC000009313282
ZINC09313282
ZINC9313282

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Available files

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