Vitas-M small molecule compound
2,4-dichlorophenyl 4-(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)cyclohexanecarboxylate (non-preferred name)
Catalog ID
STK275564
SMILES Clc1ccc(c(c1)Cl)OC(=O)C1CCC(CC1)N1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)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 C31H25Cl2NO4 MW 546.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25Cl2NO4/c32-17-11-14-24(23(33)15-17)38-31(37)16-9-12-18(13-10-16)34-29(35)27-25-19-5-1-2-6-20(19)26(28(27)30(34)36)22-8-4-3-7-21(22)25/h1-8,11,14-16,18,25-28H,9-10,12-13H2InChIKey
NMKGNVATSAQOCC-UHFFFAOYSA-NSynonyms
24dichlorophenyl4(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)cyclohexanecarboxylate(nonpreferredname)
C1CC(CCC1C(=O)OC2=C(C=C(C=C2)Cl)Cl)N3C(=O)C4C(C3=O)C5C6=CC=CC=C6C4C7=CC=CC=C57
InChI=1SC31H25Cl2NO4c3217111424(23(33)1517)3831(37)1691218(131016)3429(35)272519512620(19)26(28(27)30(34)36)22843721(22)25h18111416182528H9101213H2
MFCD03037737
ZINC000102084527
ZINC000102084536
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