Vitas-M small molecule compound
propan-2-yl {4-[(Z)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]phenoxy}acetate
Catalog ID
STK137313
SMILES N#C/C(=C/c1ccc(cc1)OCC(=O)OC(C)C)/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 C21H19N3O3 MW 361.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O3/c1-14(2)27-20(25)13-26-17-9-7-15(8-10-17)11-16(12-22)21-23-18-5-3-4-6-19(18)24-21/h3-11,14H,13H2,1-2H3,(H,23,24)/b16-11-InChIKey
PRHFNBXPNRGPOU-WJDWOHSUSA-NSynonyms
CC(C)OC(=O)COC1=CC=C(C=C1)C=C(C#N)C2=NC3=CC=CC=C3N2
InChI=1SC21H19N3O3c114(2)2720(25)1326179715(81017)1116(1222)212318534619(18)2421h31114H13H212H3(H2324)b1611
MFCD04321572
N#CC(=Cc1ccc(cc1)OCC(=O)OC(C)C)c1nc2c((nH)1)cccc2
PROPAN2YL(4((Z)2(1HBENZIMIDAZOL2YL)2CYANOETHENYL)PHENOXY)ACETATE
PROPAN2YL2(4((Z)2(1HBENZIMIDAZOL2YL)2CYANOETHENYL)PHENOXY)ACETATE
ZINC000004678901
ZINC04678901
ZINC4678901
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