Vitas-M small molecule compound
(2Z)-2-(1-methyl-1H-benzimidazol-2-yl)-3-{3-[4-(3-methylbutoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}prop-2-enenitrile
Catalog ID
STK703118
SMILES N#C/C(=C/c1cn(nc1c1ccc(cc1)OCCC(C)C)c1ccccc1)/c1nc2c(n1C)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 C31H29N5O MW 487.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29N5O/c1-22(2)17-18-37-27-15-13-23(14-16-27)30-25(21-36(34-30)26-9-5-4-6-10-26)19-24(20-32)31-33-28-11-7-8-12-29(28)35(31)3/h4-16,19,21-22H,17-18H2,1-3H3/b24-19-InChIKey
UGUMJZSPEKYTCC-CLCOLTQESA-NSynonyms
(2Z)2(1methyl1Hbenzimidazol2yl)3(3(4(3methylbutoxy)phenyl)1phenyl1Hpyrazol4yl)prop2enenitrile
(E)3(3(4(isopentyloxy)phenyl)1phenyl1Hpyrazol4yl)2(1methyl1Hbenzo(d)imidazol2yl)acrylonitrile
(Z)2(1methylbenzimidazol2yl)3(3(4(3methylbutoxy)phenyl)1phenylpyrazol4yl)prop2enenitrile
CC(C)CCOC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C3=NC4=CC=CC=C4N3C)C5=CC=CC=C5
InChI=1SC31H29N5Oc122(2)17183727151323(141627)3025(2136(3430)2695461026)1924(2032)31332811781229(28)35(31)3h416192122H1718H213H3b2419
MFCD03462392
N#CC(=Cc1cn(nc1c1ccc(cc1)OCCC(C)C)c1ccccc1)c1nc2c(n1C)cccc2
ZINC000026687714
ZINC26687714
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