Vitas-M small molecule compound
(3Z)-1-ethyl-3-({1-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]-1H-indol-3-yl}methylidene)-5-(morpholin-4-ylsulfonyl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STL448655
SMILES CCN1c2ccc(cc2/C(=C/c2cn(c3c2cccc3)CC(=O)N2CCCCC2C)/C1=O)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 C31H36N4O5S MW 576.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N4O5S/c1-3-34-29-12-11-24(41(38,39)33-14-16-40-17-15-33)19-26(29)27(31(34)37)18-23-20-32(28-10-5-4-9-25(23)28)21-30(36)35-13-7-6-8-22(35)2/h4-5,9-12,18-20,22H,3,6-8,13-17,21H2,1-2H3/b27-18-InChIKey
DFSIXFLHHADSEY-IMRQLAEWSA-NSynonyms
(3Z)1ethyl3((1(2(2methylpiperidin1yl)2oxoethyl)1Hindol3yl)methylidene)5(morpholin4ylsulfonyl)13dihydro2Hindol2one
(3Z)1ETHYL3((1(2(2METHYLPIPERIDIN1YL)2OXOETHYL)INDOL3YL)METHYLIDENE)5MORPHOLIN4YLSULFONYLINDOL2ONE
CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=CC4=CN(C5=CC=CC=C54)CC(=O)N6CCCCC6C)C1=O
CCN1c2ccc(cc2C(=Cc2cn(c3c2cccc3)CC(=O)N2CCCCC2C)C1=O)S(=O)(=O)N1CCOCC1
InChI=1SC31H36N4O5Sc133429121124(41(3839)33141640171533)1926(29)27(31(34)37)18232032(281054925(23)28)2130(36)351376822(35)2h45912182022H368131721H212H3b2718
MFCD05133835
ZINC000008778039
ZINC000008778040
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