Vitas-M small molecule compound

(2Z)-2-(1H-benzimidazol-2-yl)-3-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)prop-2-enenitrile hydrochloride

Catalog ID
STL432015
SMILES N#C/C(=C/c1ccc2c(c1)CC(O2)C)/c1nc2c([nH]1)cccc2.Cl

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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 C19H16ClN3O MW 337.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O.ClH/c1-12-8-14-9-13(6-7-18(14)23-12)10-15(11-20)19-21-16-4-2-3-5-17(16)22-19;/h2-7,9-10,12H,8H2,1H3,(H,21,22);1H/b15-10-;
InChIKey
KHAMJIULVYRVSI-AZJSCORLSA-N
Synonyms

(2Z)2(1Hbenzimidazol2yl)3(2methyl23dihydro1benzofuran5yl)prop2enenitrilehydrochloride
(2Z)2BENZIMIDAZOL2YL3(2METHYL(23DIHYDROBENZO(B)FURAN5YL))PROP2ENENITRILECHLORIDE
(Z)2(1HBENZIMIDAZOL2YL)3(2METHYL23DIHYDRO1BENZOFURAN5YL)PROP2ENENITRILEHYDROCHLORIDE
CC1CC2=C(O1)C=CC(=C2)C=C(C#N)C3=NC4=CC=CC=C4N3Cl
InChI=1SC19H15N3OClHc112814913(6718(14)2312)1015(1120)192116423517(16)2219h2791012H8H21H3(H2122)1Hb1510
MFCD03307276
N#CC(=Cc1ccc2c(c1)CC(O2)C)c1nc2c((nH)1)cccc2Cl
ZINC000004453702
ZINC000004453703

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Available files

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