Vitas-M small molecule compound
(2Z)-2-(1H-benzimidazol-2-yl)-3-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enenitrile
Catalog ID
STK865915
SMILES N#C/C(=C/c1cn(nc1c1ccc(cc1)Cl)c1ccccc1)/c1nc2c([nH]1)cccc2
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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 C25H16ClN5 MW 421.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H16ClN5/c26-20-12-10-17(11-13-20)24-19(16-31(30-24)21-6-2-1-3-7-21)14-18(15-27)25-28-22-8-4-5-9-23(22)29-25/h1-14,16H,(H,28,29)/b18-14-InChIKey
UFGJYIBOHRMBJA-JXAWBTAJSA-NSynonyms
(2Z)2(1Hbenzimidazol2yl)3(3(4chlorophenyl)1phenyl1Hpyrazol4yl)prop2enenitrile
(Z)2(1Hbenzimidazol2yl)3(3(4chlorophenyl)1phenylpyrazol4yl)prop2enenitrile
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)C=C(C#N)C4=NC5=CC=CC=C5N4
InChI=1SC25H16ClN5c2620121017(111320)2419(1631(3024)216213721)1418(1527)252822845923(22)2925h11416H(H2829)b1814
MFCD03212338
N#CC(=Cc1cn(nc1c1ccc(cc1)Cl)c1ccccc1)c1nc2c((nH)1)cccc2
ZINC000027017181
ZINC27017181
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