Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-{3-chloro-4-[(2-chlorobenzyl)oxy]-5-methoxyphenyl}prop-2-enenitrile
Catalog ID
STK720228
SMILES COc1cc(cc(c1OCc1ccccc1Cl)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/c1-30-22-12-15(10-17(13-27)24-28-20-8-4-5-9-21(20)29-24)11-19(26)23(22)31-14-16-6-2-3-7-18(16)25/h2-12H,14H2,1H3,(H,28,29)/b17-10+InChIKey
DPVKIRJHWIXGEC-LICLKQGHSA-NSynonyms
(2E)2(1Hbenzimidazol2yl)3(3chloro4((2chlorobenzyl)oxy)5methoxyphenyl)prop2enenitrile
(E)2(1HBENZIMIDAZOL2YL)3(3CHLORO4((2CHLOROPHENYL)METHOXY)5METHOXYPHENYL)PROP2ENENITRILE
COC1=C(C(=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)Cl)OCC4=CC=CC=C4Cl
COc1cc(cc(c1OCc1ccccc1Cl)Cl)C=C(c1nc2c((nH)1)cccc2)C#N
InChI=1SC24H17Cl2N3O2c130221215(1017(1327)242820845921(20)2924)1119(26)23(22)311416623718(16)25h212H14H21H3(H2829)b1710+
MFCD03763606
ZINC000008590682
ZINC08590682
ZINC8590682
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