Vitas-M small molecule compound

(3Z)-3-[(5-bromo-1H-indol-3-yl)methylidene]-1-methyl-5-(morpholin-4-ylsulfonyl)-1,3-dihydro-2H-indol-2-one

Catalog ID
STL448606
SMILES CN1C(=O)/C(=C\c2c[nH]c3c2cc(Br)cc3)/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 C22H20BrN3O4S MW 502.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O4S/c1-25-21-5-3-16(31(28,29)26-6-8-30-9-7-26)12-18(21)19(22(25)27)10-14-13-24-20-4-2-15(23)11-17(14)20/h2-5,10-13,24H,6-9H2,1H3/b19-10-
InChIKey
OWYGARKGVCYZKJ-GRSHGNNSSA-N
Synonyms

(3Z)3((5bromo1Hindol3yl)methylidene)1methyl5(morpholin4ylsulfonyl)13dihydro2Hindol2one
(3Z)3((5BROMO1HINDOL3YL)METHYLIDENE)1METHYL5MORPHOLIN4YLSULFONYLINDOL2ONE
CN1C(=O)C(=Cc2c(nH)c3c2cc(Br)cc3)c2c1ccc(c2)S(=O)(=O)N1CCOCC1
CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=CC4=CNC5=C4C=C(C=C5)Br)C1=O
InChI=1SC22H20BrN3O4Sc125215316(31(2829)2668309726)1218(21)19(22(25)27)10141324204215(23)1117(14)20h25101324H69H21H3b1910
MFCD07774068
ZINC000016957364
ZINC16957364

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Available files

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