Vitas-M small molecule compound
butyl 4-(3-{(E)-[1-ethyl-5-(morpholin-4-ylsulfonyl)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]methyl}-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Catalog ID
STL448709
SMILES CCCCOC(=O)c1ccc(cc1)n1c(C)cc(c1C)/C=C/1\c2cc(ccc2N(C1=O)CC)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 C32H37N3O6S MW 591.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H37N3O6S/c1-5-7-16-41-32(37)24-8-10-26(11-9-24)35-22(3)19-25(23(35)4)20-29-28-21-27(12-13-30(28)34(6-2)31(29)36)42(38,39)33-14-17-40-18-15-33/h8-13,19-21H,5-7,14-18H2,1-4H3/b29-20+InChIKey
RVUANHNPGXEBCS-ZTKZIYFRSA-NSynonyms
butyl4(3((E)(1ethyl5(morpholin4ylsulfonyl)2oxo12dihydro3Hindol3ylidene)methyl)25dimethyl1Hpyrrol1yl)benzoate
butyl4(3((E)(1ethyl5morpholin4ylsulfonyl2oxoindol3ylidene)methyl)25dimethylpyrrol1yl)benzoate
CCCCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C4=C(C=CC(=C4)S(=O)(=O)N5CCOCC5)N(C3=O)CC)C
CCCCOC(=O)c1ccc(cc1)n1c(C)cc(c1C)C=C1c2cc(ccc2N(C1=O)CC)S(=O)(=O)N1CCOCC1
InChI=1SC32H37N3O6Sc157164132(37)2481026(11924)3522(3)1925(23(35)4)2029282127(121330(28)34(62)31(29)36)42(3839)33141740181533h8131921H571418H214H3b2920+
MFCD30712995
ZINC000101377527
ZINC101377527
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