Vitas-M small molecule compound
2-amino-4-[4-(benzyloxy)phenyl]-3-cyano-4H-chromen-7-yl 3-chlorobenzoate
Catalog ID
STK912807
SMILES N#CC1=C(N)Oc2c(C1c1ccc(cc1)OCc1ccccc1)ccc(c2)OC(=O)c1cccc(c1)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 C30H21ClN2O4 MW 508.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H21ClN2O4/c31-22-8-4-7-21(15-22)30(34)36-24-13-14-25-27(16-24)37-29(33)26(17-32)28(25)20-9-11-23(12-10-20)35-18-19-5-2-1-3-6-19/h1-16,28H,18,33H2InChIKey
AGPBYEIFTMMMJD-UHFFFAOYSA-NSynonyms
(2amino3cyano4(4phenylmethoxyphenyl)4Hchromen7yl)3chlorobenzoate
2amino4(4(benzyloxy)phenyl)3cyano4Hchromen7yl3chlorobenzoate
C1=CC=C(C=C1)COC2=CC=C(C=C2)C3C4=C(C=C(C=C4)OC(=O)C5=CC(=CC=C5)Cl)OC(=C3C#N)N
InChI=1SC30H21ClN2O4c312284721(1522)30(34)362413142527(1624)3729(33)26(1732)28(25)2091123(121020)3518195213619h11628H1833H2
MFCD07427756
ZINC000008917322
ZINC000008917323
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