Vitas-M small molecule compound
(3Z)-3-{[2,5-dimethyl-1-(tetrahydrofuran-2-ylmethyl)-1H-pyrrol-3-yl]methylidene}-1-methyl-5-(morpholin-4-ylsulfonyl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STL477328
SMILES O=C1N(C)c2c(/C/1=C/c1cc(n(c1C)CC1CCCO1)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 C25H31N3O5S MW 485.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O5S/c1-17-13-19(18(2)28(17)16-20-5-4-10-33-20)14-23-22-15-21(6-7-24(22)26(3)25(23)29)34(30,31)27-8-11-32-12-9-27/h6-7,13-15,20H,4-5,8-12,16H2,1-3H3/b23-14-InChIKey
FSJGEOUUJFAVIY-UCQKPKSFSA-NSynonyms
(3Z)3((25DIMETHYL1(OXOLAN2YLMETHYL)PYRROL3YL)METHYLIDENE)1METHYL5MORPHOLIN4YLSULFONYLINDOL2ONE
(3Z)3((25dimethyl1(tetrahydrofuran2ylmethyl)1Hpyrrol3yl)methylidene)1methyl5(morpholin4ylsulfonyl)13dihydro2Hindol2one
CC1=CC(=C(N1CC2CCCO2)C)C=C3C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)N(C3=O)C
InChI=1SC25H31N3O5Sc1171319(18(2)28(17)162054103320)1423221521(6724(22)26(3)25(23)29)34(3031)278113212927h67131520H4581216H213H3b2314
MFCD07756598
O=C1N(C)c2c(C1=Cc1cc(n(c1C)CC1CCCO1)C)cc(cc2)S(=O)(=O)N1CCOCC1
ZINC000016957376
ZINC000016957377
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