Vitas-M small molecule compound
(3Z)-3-benzylidene-5-(4-chlorophenyl)-1-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)phenyl]-1,3-dihydro-2H-pyrrol-2-one
Catalog ID
STK199197
SMILES Clc1ccc(cc1)C1=C/C(=C/c2ccccc2)/C(=O)N1c1ccc(cc1)C12CC3CC(C2)CC(C1)C3
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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 C33H30ClNO MW 492.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30ClNO/c34-29-10-6-26(7-11-29)31-18-27(17-22-4-2-1-3-5-22)32(36)35(31)30-12-8-28(9-13-30)33-19-23-14-24(20-33)16-25(15-23)21-33/h1-13,17-18,23-25H,14-16,19-21H2/b27-17-InChIKey
CJDRCHHKCAAQLJ-PKAZHMFMSA-NSynonyms
(3Z)1(4(1adamantyl)phenyl)3benzylidene5(4chlorophenyl)pyrrol2one
(3Z)3benzylidene5(4chlorophenyl)1(4(tricyclo(3311~37~)dec1yl)phenyl)13dihydro2Hpyrrol2one
C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)N5C(=CC(=CC6=CC=CC=C6)C5=O)C7=CC=C(C=C7)Cl
Clc1ccc(cc1)C1=CC(=Cc2ccccc2)C(=O)N1c1ccc(cc1)C12CC3CC(C2)CC(C1)C3
InChI=1SC33H30ClNOc342910626(71129)311827(17224213522)32(36)35(31)3012828(91330)3319231424(2033)1625(1523)2133h11317182325H14161921H2b2717
MFCD06150698
ZINC000009323964
ZINC09323964
ZINC9323964
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