Vitas-M small molecule compound
2-{[(E)-(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]amino}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Catalog ID
STK263882
SMILES CCOc1c(I)cc(cc1OC)/C=N/N1C(=O)C2C(C1=O)C1C=CC2C2C1C2
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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 C21H21IN2O4 MW 492.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21IN2O4/c1-3-28-19-15(22)6-10(7-16(19)27-2)9-23-24-20(25)17-11-4-5-12(14-8-13(11)14)18(17)21(24)26/h4-7,9,11-14,17-18H,3,8H2,1-2H3/b23-9+InChIKey
YTNXODAIHFCHJH-NUGSKGIGSA-NSynonyms
2(((E)(4ETHOXY3IODO5METHOXYPHENYL)METHYLIDENE)AMINO)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
CCOC1=C(C=C(C=C1I)C=NN2C(=O)C3C4C=CC(C3C2=O)C5C4C5)OC
CCOc1c(I)cc(cc1OC)C=NN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
InChI=1SC21H21IN2O4c13281915(22)610(716(19)272)9232420(25)17114512(14813(11)14)18(17)21(24)26h47911141718H38H212H3b239+
MFCD03714419
ZINC000245227083
ZINC000245227086
Check stock
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