Vitas-M small molecule compound
17-({(E)-[5-(2,3-dichlorophenyl)furan-2-yl]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
STL369894
SMILES O=C1N(/N=C/c2ccc(o2)c2cccc(c2Cl)Cl)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 C29H18Cl2N2O3 MW 513.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H18Cl2N2O3/c30-21-11-5-10-20(27(21)31)22-13-12-15(36-22)14-32-33-28(34)25-23-16-6-1-2-7-17(16)24(26(25)29(33)35)19-9-4-3-8-18(19)23/h1-14,23-26H/b32-14+InChIKey
KXVFZDOLQHTRMD-HIWRWHBISA-NSynonyms
17(((E)(5(23dichlorophenyl)furan2yl)methylidene)amino)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
C1=CC=C2C3C4C(C(C2=C1)C5=CC=CC=C35)C(=O)N(C4=O)N=CC6=CC=C(O6)C7=C(C(=CC=C7)Cl)Cl
InChI=1SC29H18Cl2N2O3c30211151020(27(21)31)22131215(3622)14323328(34)252316612717(16)24(26(25)29(33)35)19943818(19)23h1142326Hb3214+
MFCD03763260
O=C1N(N=Cc2ccc(o2)c2cccc(c2Cl)Cl)C(=O)C2C1C1c3ccccc3C2c2c1cccc2
ZINC000015226379
ZINC000018066179
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