Vitas-M small molecule compound
17-[4-(methylsulfanyl)-1-(morpholin-4-yl)-1-oxobutan-2-yl]-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
STK269239
SMILES CSCCC(N1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3)C(=O)N1CCOCC1
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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 C27H28N2O4S MW 476.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O4S/c1-34-15-10-20(25(30)28-11-13-33-14-12-28)29-26(31)23-21-16-6-2-3-7-17(16)22(24(23)27(29)32)19-9-5-4-8-18(19)21/h2-9,20-24H,10-15H2,1H3InChIKey
YBBVPROTJAXFJH-UHFFFAOYSA-NSynonyms
17(4(methylsulfanyl)1(morpholin4yl)1oxobutan2yl)17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CSCCC(C(=O)N1CCOCC1)N2C(=O)C3C(C2=O)C4C5=CC=CC=C5C3C6=CC=CC=C46
InChI=1SC27H28N2O4Sc134151020(25(30)28111333141228)2926(31)232116623717(16)22(24(23)27(29)32)19954818(19)21h292024H1015H21H3
MFCD02028506
ZINC000004180369
ZINC000018178330
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