Vitas-M small molecule compound
2-chlorobenzyl 4-{5-[(1Z)-3-amino-2,4,4-tricyanobuta-1,3-dien-1-yl]furan-2-yl}benzoate
Catalog ID
STK113730
SMILES N#C/C(=C\c1ccc(o1)c1ccc(cc1)C(=O)OCc1ccccc1Cl)/C(=C(C#N)C#N)N
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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 C25H15ClN4O3 MW 454.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H15ClN4O3/c26-22-4-2-1-3-18(22)15-32-25(31)17-7-5-16(6-8-17)23-10-9-21(33-23)11-19(12-27)24(30)20(13-28)14-29/h1-11H,15,30H2/b19-11+InChIKey
JRWBIESIXQNXJH-YBFXNURJSA-NSynonyms
(2CHLOROPHENYL)METHYL4(5((1Z)3AMINO244TRICYANOBUTA13DIENYL)FURAN2YL)BENZOATE2CHLOROBENZYL4(5((1Z)3AMINO244TRICYANOBUTA13DIEN1YL)FURAN2YL)BENZOATE
C1=CC=C(C(=C1)COC(=O)C2=CC=C(C=C2)C3=CC=C(O3)C=C(C#N)C(=C(C#N)C#N)N)Cl
N#CC(=Cc1ccc(o1)c1ccc(cc1)C(=O)OCc1ccccc1Cl)C(=C(C#N)C#N)N
Registry IDs
MFCD05625641ZINC000095536315
ZINC95536315
Check stock
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