Vitas-M small molecule compound
(3Z)-3-{[1-(2,3-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methyl-5-(morpholin-4-ylsulfonyl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STL441578
SMILES O=C1N(C)c2c(/C/1=C/c1cc(n(c1C)c1cccc(c1C)C)C)cc(cc2)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 C28H31N3O4S MW 505.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O4S/c1-18-7-6-8-26(20(18)3)31-19(2)15-22(21(31)4)16-25-24-17-23(9-10-27(24)29(5)28(25)32)36(33,34)30-11-13-35-14-12-30/h6-10,15-17H,11-14H2,1-5H3/b25-16-InChIKey
RWDLRCLSSWTVFD-XYGWBWBKSA-NSynonyms
(3Z)3((1(23dimethylphenyl)25dimethyl1Hpyrrol3yl)methylidene)1methyl5(morpholin4ylsulfonyl)13dihydro2Hindol2one
(3Z)3((1(23DIMETHYLPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1METHYL5MORPHOLIN4YLSULFONYLINDOL2ONE
CC1=C(C(=CC=C1)N2C(=CC(=C2C)C=C3C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)N(C3=O)C)C)C
InChI=1SC28H31N3O4Sc11876826(20(18)3)3119(2)1522(21(31)4)1625241723(91027(24)29(5)28(25)32)36(3334)30111335141230h6101517H1114H215H3b2516
MFCD07773968
O=C1N(C)c2c(C1=Cc1cc(n(c1C)c1cccc(c1C)C)C)cc(cc2)S(=O)(=O)N1CCOCC1
ZINC000008777659
ZINC8777659
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