Vitas-M small molecule compound
4-(2-amino-3-cyano-5-oxo-5,6,7,8-tetrahydro-4H-chromen-4-yl)phenyl 2-chlorobenzoate
Catalog ID
STK762536
SMILES N#CC1=C(N)OC2=C(C1c1ccc(cc1)OC(=O)c1ccccc1Cl)C(=O)CCC2
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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 C23H17ClN2O4 MW 420.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17ClN2O4/c24-17-5-2-1-4-15(17)23(28)29-14-10-8-13(9-11-14)20-16(12-25)22(26)30-19-7-3-6-18(27)21(19)20/h1-2,4-5,8-11,20H,3,6-7,26H2InChIKey
XFNFPMJHZHFMTL-UHFFFAOYSA-NSynonyms
(4(2amino3cyano5oxo4678tetrahydrochromen4yl)phenyl)2chlorobenzoate
4(2amino3cyano5oxo5678tetrahydro4Hchromen4yl)phenyl2chlorobenzoate
C1CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4Cl)C(=O)C1
InChI=1SC23H17ClN2O4c2417521415(17)23(28)291410813(91114)2016(1225)22(26)301973618(27)21(19)20h124581120H36726H2
MFCD01872110
ZINC000001066072
ZINC000001066074
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