Vitas-M small molecule compound

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

Catalog ID
STL448620
SMILES Brc1ccc2c(c1)c(/C=C/1\C(=O)N(c3c1cc(cc3)S(=O)(=O)N1CCOCC1)C)cn2CC(=O)N1CCCCCC1

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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 C30H33BrN4O5S MW 641.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33BrN4O5S/c1-32-27-9-7-23(41(38,39)35-12-14-40-15-13-35)18-25(27)26(30(32)37)16-21-19-34(28-8-6-22(31)17-24(21)28)20-29(36)33-10-4-2-3-5-11-33/h6-9,16-19H,2-5,10-15,20H2,1H3/b26-16-
InChIKey
DQQWRQSNHLEBFM-QQXSKIMKSA-N
Synonyms

(3Z)3((1(2(azepan1yl)2oxoethyl)5bromo1Hindol3yl)methylidene)1methyl5(morpholin4ylsulfonyl)13dihydro2Hindol2one
(3Z)3((1(2(AZEPAN1YL)2OXOETHYL)5BROMOINDOL3YL)METHYLIDENE)1METHYL5MORPHOLIN4YLSULFONYLINDOL2ONE
Brc1ccc2c(c1)c(C=C1C(=O)N(c3c1cc(cc3)S(=O)(=O)N1CCOCC1)C)cn2CC(=O)N1CCCCCC1
CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=CC4=CN(C5=C4C=C(C=C5)Br)CC(=O)N6CCCCCC6)C1=O
InChI=1SC30H33BrN4O5Sc132279723(41(3839)35121440151335)1825(27)26(30(32)37)16211934(288622(31)1724(21)28)2029(36)331042351133h691619H25101520H21H3b2616
MFCD05132859
ZINC000150350749
ZINC150350749

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Available files

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