Vitas-M small molecule compound
4'-[(4-methoxyphenyl)carbonyl]-3'-[(E)-2-phenylethenyl]-4'H-spiro[indole-3,5'-[1,2]oxazol]-2(1H)-one
Catalog ID
STL058629
SMILES COc1ccc(cc1)C(=O)C1C(=NOC21C(=O)Nc1c2cccc1)/C=C/c1ccccc1
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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 C26H20N2O4 MW 424.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O4/c1-31-19-14-12-18(13-15-19)24(29)23-22(16-11-17-7-3-2-4-8-17)28-32-26(23)20-9-5-6-10-21(20)27-25(26)30/h2-16,23H,1H3,(H,27,30)/b16-11+InChIKey
YSIMMZMXBIZODJ-LFIBNONCSA-NSynonyms
(3R4S)4(4methoxybenzoyl)3((E)styryl)4Hspiro(indoline35isoxazol)2one
4((4methoxyphenyl)carbonyl)3((E)2phenylethenyl)4Hspiro(indole35(12)oxazol)2(1H)one
4(4methoxybenzoyl)3((E)2phenylethenyl)spiro(1Hindole354H12oxazole)2one
COC1=CC=C(C=C1)C(=O)C2C(=NOC23C4=CC=CC=C4NC3=O)C=CC5=CC=CC=C5
COc1ccc(cc1)C(=O)(C@H)1C(=NO(C@@)21C(=O)Nc1c2cccc1)C=Cc1ccccc1
COc1ccc(cc1)C(=O)C1C(=NOC21C(=O)Nc1c2cccc1)C=Cc1ccccc1
InChI=1SC26H20N2O4c13119141218(131519)24(29)2322(1611177324817)283226(23)209561021(20)2725(26)30h21623H1H3(H2730)b1611+
MFCD18192994
ZINC000013691927
ZINC000036576565
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