Vitas-M small molecule compound
(2E)-2-(1H-benzimidazol-2-yl)-3-[2-butoxy-4-(diethylamino)phenyl]prop-2-enenitrile
Catalog ID
STL431265
SMILES CCCCOc1cc(ccc1/C=C(/c1nc2c([nH]1)cccc2)\C#N)N(CC)CC
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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 C24H28N4O MW 388.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O/c1-4-7-14-29-23-16-20(28(5-2)6-3)13-12-18(23)15-19(17-25)24-26-21-10-8-9-11-22(21)27-24/h8-13,15-16H,4-7,14H2,1-3H3,(H,26,27)/b19-15+InChIKey
PVVUTKIJROXBQZ-XDJHFCHBSA-NSynonyms
(2E)2(1Hbenzimidazol2yl)3(2butoxy4(diethylamino)phenyl)prop2enenitrile
(E)2(1HBENZIMIDAZOL2YL)3(2BUTOXY4(DIETHYLAMINO)PHENYL)PROP2ENENITRILE
CCCCOC1=C(C=CC(=C1)N(CC)CC)C=C(C#N)C2=NC3=CC=CC=C3N2
CCCCOc1cc(ccc1C=C(c1nc2c((nH)1)cccc2)C#N)N(CC)CC
InChI=1SC24H28N4Oc1471429231620(28(52)63)131218(23)1519(1725)24262110891122(21)2724h8131516H4714H213H3(H2627)b1915+
MFCD03307168
ZINC000032099444
ZINC32099444
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