Vitas-M small molecule compound
(3Z)-3-[(1-benzyl-5-bromo-1H-indol-3-yl)methylidene]-1-ethyl-5-(morpholin-4-ylsulfonyl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STL448651
SMILES CCN1C(=O)/C(=C\c2cn(c3c2cc(Br)cc3)Cc2ccccc2)/c2c1ccc(c2)S(=O)(=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 C30H28BrN3O4S MW 606.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28BrN3O4S/c1-2-34-29-11-9-24(39(36,37)33-12-14-38-15-13-33)18-26(29)27(30(34)35)16-22-20-32(19-21-6-4-3-5-7-21)28-10-8-23(31)17-25(22)28/h3-11,16-18,20H,2,12-15,19H2,1H3/b27-16-InChIKey
NCPGISIKCFFKFF-YUMHPJSZSA-NSynonyms
(3Z)3((1benzyl5bromo1Hindol3yl)methylidene)1ethyl5(morpholin4ylsulfonyl)13dihydro2Hindol2one
(3Z)3((1BENZYL5BROMOINDOL3YL)METHYLIDENE)1ETHYL5MORPHOLIN4YLSULFONYLINDOL2ONE
CCN1C(=O)C(=Cc2cn(c3c2cc(Br)cc3)Cc2ccccc2)c2c1ccc(c2)S(=O)(=O)N1CCOCC1
CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=CC4=CN(C5=C4C=C(C=C5)Br)CC6=CC=CC=C6)C1=O
InChI=1SC30H28BrN3O4Sc12342911924(39(3637)33121438151333)1826(29)27(30(34)35)16222032(19216435721)2810823(31)1725(22)28h311161820H2121519H21H3b2716
MFCD05133817
ZINC000008778037
ZINC8778037
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