Vitas-M small molecule compound
17-({(E)-[4-(naphthalen-1-ylmethoxy)phenyl]methylidene}amino)-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaene-16,18-dione (non-preferred name)
Catalog ID
STL369914
SMILES O=C1N(/N=C/c2ccc(cc2)OCc2cccc3c2cccc3)C(=O)C2C1C1c3ccccc3C2c2c1cccc2
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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 C36H26N2O3 MW 534.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H26N2O3/c39-35-33-31-27-12-3-4-13-28(27)32(30-15-6-5-14-29(30)31)34(33)36(40)38(35)37-20-22-16-18-25(19-17-22)41-21-24-10-7-9-23-8-1-2-11-26(23)24/h1-20,31-34H,21H2/b37-20+InChIKey
TVZAPVFMHIGGDU-HASSKWOGSA-NSynonyms
17(((E)(4(naphthalen1ylmethoxy)phenyl)methylidene)amino)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
C1=CC=C2C(=C1)C=CC=C2COC3=CC=C(C=C3)C=NN4C(=O)C5C(C4=O)C6C7=CC=CC=C7C5C8=CC=CC=C68
InChI=1SC36H26N2O3c393533312712341328(27)32(3015651429(30)31)34(33)36(40)38(35)372022161825(191722)4121241079238121126(23)24h1203134H21H2b3720+
MFCD06669062
O=C1N(N=Cc2ccc(cc2)OCc2cccc3c2cccc3)C(=O)C2C1C1c3ccccc3C2c2c1cccc2
ZINC000097966023
ZINC000097966025
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