Vitas-M small molecule compound
17-(5-chloro-2-methylphenyl)-1-ethyl-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
STK264337
SMILES CCC12C3C(=O)N(C(=O)C3C(c3c1cccc3)c1c2cccc1)c1cc(Cl)ccc1C
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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 C27H22ClNO2 MW 427.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22ClNO2/c1-3-27-19-10-6-4-8-17(19)22(18-9-5-7-11-20(18)27)23-24(27)26(31)29(25(23)30)21-14-16(28)13-12-15(21)2/h4-14,22-24H,3H2,1-2H3InChIKey
UGROLCMXIFZHQM-UHFFFAOYSA-NSynonyms
17(5chloro2methylphenyl)1ethyl17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaene1618dione(nonpreferredname)
CCC12C3C(C(C4=CC=CC=C41)C5=CC=CC=C25)C(=O)N(C3=O)C6=C(C=CC(=C6)Cl)C
InChI=1SC27H22ClNO2c1327191064817(19)22(189571120(18)27)2324(27)26(31)29(25(23)30)211416(28)131215(21)2h4142224H3H212H3
MFCD01802354
ZINC000001168193
ZINC000001168196
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