Vitas-M small molecule compound
2-benzyl-8-[bis(4-methoxyphenyl)methylidene]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STK364997
SMILES COc1ccc(cc1)/C(=C\1/C2C=CC1C1C2C(=O)N(C1=O)Cc1ccccc1)/c1ccc(cc1)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 C31H27NO4 MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27NO4/c1-35-22-12-8-20(9-13-22)26(21-10-14-23(36-2)15-11-21)27-24-16-17-25(27)29-28(24)30(33)32(31(29)34)18-19-6-4-3-5-7-19/h3-17,24-25,28-29H,18H2,1-2H3InChIKey
JALGVJJBNPXALR-UHFFFAOYSA-NSynonyms
2BENZYL8(BIS(4METHOXYPHENYL)METHYLIDENE)3A477ATETRAHYDRO1H47METHANOISOINDOLE13(2H)DIONE
COC1=CC=C(C=C1)C(=C2C3C=CC2C4C3C(=O)N(C4=O)CC5=CC=CC=C5)C6=CC=C(C=C6)OC
COc1ccc(cc1)C(=C1C2C=CC1C1C2C(=O)N(C1=O)Cc1ccccc1)c1ccc(cc1)OC
InChI=1SC31H27NO4c1352212820(91322)26(21101423(362)151121)2724161725(27)2928(24)30(33)32(31(29)34)18196435719h31724252829H18H212H3
MFCD03553384
ZINC000101025119
ZINC000239321997
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