Vitas-M small molecule compound
ethyl 2-chloro-5-(1,8-dimethyl-16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)benzoate (non-preferred name)
Catalog ID
STK256911
SMILES CCOC(=O)c1cc(ccc1Cl)N1C(=O)C2C(C1=O)C1(C)c3c(C2(C)c2c1cccc2)cccc3
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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 C29H24ClNO4 MW 485.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24ClNO4/c1-4-35-27(34)17-15-16(13-14-22(17)30)31-25(32)23-24(26(31)33)29(3)20-11-7-5-9-18(20)28(23,2)19-10-6-8-12-21(19)29/h5-15,23-24H,4H2,1-3H3InChIKey
GXZMZYPHPGZNEO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C=CC(=C1)N2C(=O)C3C(C2=O)C4(C5=CC=CC=C5C3(C6=CC=CC=C64)C)C)Cl
ethyl2chloro5(18dimethyl1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)benzoate(nonpreferredname)
InChI=1SC29H24ClNO4c143527(34)171516(131422(17)30)3125(32)2324(26(31)33)29(3)201175918(20)28(232)1910681221(19)29h5152324H4H213H3
MFCD03714483
ZINC000001135231
ZINC000001135234
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