Vitas-M small molecule compound

1-(3-chloro-4-methylphenyl)-3,5-bis(3,4-dimethoxyphenyl)-4-methyl-1H-pyrazole

Catalog ID
STL386885
SMILES COc1cc(ccc1OC)c1nn(c(c1C)c1ccc(c(c1)OC)OC)c1ccc(c(c1)Cl)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 C27H27ClN2O4 MW 478.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27ClN2O4/c1-16-7-10-20(15-21(16)28)30-27(19-9-12-23(32-4)25(14-19)34-6)17(2)26(29-30)18-8-11-22(31-3)24(13-18)33-5/h7-15H,1-6H3
InChIKey
HJYYSZWBWKJKGL-UHFFFAOYSA-N
Synonyms
1006332-27-9
1(3CHLORO4METHYLPHENYL)35BIS(34DIMETHOXYPHENYL)4METHYL1HPYRAZOLE
1(3chloro4methylphenyl)35bis(34dimethoxyphenyl)4methylpyrazole
1006332279
CC1=C(C=C(C=C1)N2C(=C(C(=N2)C3=CC(=C(C=C3)OC)OC)C)C4=CC(=C(C=C4)OC)OC)Cl
InChI=1SC27H27ClN2O4c11671020(1521(16)28)3027(1991223(324)25(1419)346)17(2)26(2930)1881122(313)24(1318)335h715H16H3
MFCD08551820
ZINC000002733270
ZINC02733270
ZINC2733270

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Available files

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