Vitas-M small molecule compound
(3Z)-3-({7-ethyl-1-[2-oxo-2-(piperidin-1-yl)ethyl]-1H-indol-3-yl}methylidene)-1-methyl-5-(morpholin-4-ylsulfonyl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STL441567
SMILES CCc1cccc2c1n(CC(=O)N1CCCCC1)cc2/C=C/1\C(=O)N(c2c1cc(cc2)S(=O)(=O)N1CCOCC1)C
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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/c1-3-22-8-7-9-25-23(20-34(30(22)25)21-29(36)33-12-5-4-6-13-33)18-27-26-19-24(10-11-28(26)32(2)31(27)37)41(38,39)35-14-16-40-17-15-35/h7-11,18-20H,3-6,12-17,21H2,1-2H3/b27-18-InChIKey
IGPMGACUDKTMKA-IMRQLAEWSA-NSynonyms
(3Z)3((7ethyl1(2oxo2(piperidin1yl)ethyl)1Hindol3yl)methylidene)1methyl5(morpholin4ylsulfonyl)13dihydro2Hindol2one
(3Z)3((7ETHYL1(2OXO2PIPERIDIN1YLETHYL)INDOL3YL)METHYLIDENE)1METHYL5MORPHOLIN4YLSULFONYLINDOL2ONE
CCC1=CC=CC2=C1N(C=C2C=C3C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)N(C3=O)C)CC(=O)N6CCCCC6
CCc1cccc2c1n(CC(=O)N1CCCCC1)cc2C=C1C(=O)N(c2c1cc(cc2)S(=O)(=O)N1CCOCC1)C
InChI=1SC31H36N4O5Sc13228792523(2034(30(22)25)2129(36)33125461333)1827261924(101128(26)32(2)31(27)37)41(3839)35141640171535h7111820H36121721H212H3b2718
MFCD05132749
ZINC000008777636
ZINC8777636
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