Vitas-M small molecule compound
methyl 2-{[(2E)-2-cyano-3-(3-phenyl-2,1-benzoxazol-5-yl)prop-2-enoyl]amino}benzoate
Catalog ID
STL022521
SMILES N#C/C(=C\c1ccc2c(c1)c(on2)c1ccccc1)/C(=O)Nc1ccccc1C(=O)OC
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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 C25H17N3O4 MW 423.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17N3O4/c1-31-25(30)19-9-5-6-10-21(19)27-24(29)18(15-26)13-16-11-12-22-20(14-16)23(32-28-22)17-7-3-2-4-8-17/h2-14H,1H3,(H,27,29)/b18-13+InChIKey
LRDIZJHPHWMXSE-QGOAFFKASA-NSynonyms
868154-48-7868154487
COC(=O)C1=CC=CC=C1NC(=O)C(=CC2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C#N
InChI=1SC25H17N3O4c13125(30)199561021(19)2724(29)18(1526)131611122220(1416)23(322822)177324817h214H1H3(H2729)b1813+
methyl2(((2E)2cyano3(3phenyl21benzoxazol5yl)prop2enoyl)amino)benzoate
METHYL2(((E)2CYANO3(3PHENYL21BENZOXAZOL5YL)PROP2ENOYL)AMINO)BENZOATE
METHYL2((2E)2CYANO3(3PHENYLBENZO(C)ISOXAZOL5YL)PROP2ENOYLAMINO)BENZOATE
MFCD06405310
N#CC(=Cc1ccc2c(c1)c(on2)c1ccccc1)C(=O)Nc1ccccc1C(=O)OC
ZINC000002708479
ZINC02708479
ZINC2708479
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