Vitas-M small molecule compound
(2Z)-2-(1H-benzimidazol-2-yl)-3-{3-chloro-4-[(4-chlorobenzyl)oxy]-5-methoxyphenyl}prop-2-enenitrile
Catalog ID
STK296538
SMILES COc1cc(cc(c1OCc1ccc(cc1)Cl)Cl)/C=C(\c1nc2c([nH]1)cccc2)/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 C24H17Cl2N3O2 MW 450.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17Cl2N3O2/c1-30-22-12-16(10-17(13-27)24-28-20-4-2-3-5-21(20)29-24)11-19(26)23(22)31-14-15-6-8-18(25)9-7-15/h2-12H,14H2,1H3,(H,28,29)/b17-10-InChIKey
UOKSCNSXMKPIHN-YVLHZVERSA-NSynonyms
(2Z)2(1Hbenzimidazol2yl)3(3chloro4((4chlorobenzyl)oxy)5methoxyphenyl)prop2enenitrile
(Z)2(1HBENZIMIDAZOL2YL)3(3CHLORO4((4CHLOROPHENYL)METHOXY)5METHOXYPHENYL)PROP2ENENITRILE
COC1=C(C(=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)Cl)OCC4=CC=C(C=C4)Cl
COc1cc(cc(c1OCc1ccc(cc1)Cl)Cl)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC24H17Cl2N3O2c130221216(1017(1327)242820423521(20)2924)1119(26)23(22)3114156818(25)9715h212H14H21H3(H2829)b1710
MFCD06002842
ZINC000016399643
ZINC16399643
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