Vitas-M small molecule compound
(3Z)-3-{[1-(2,4-dichlorobenzyl)-1H-indol-3-yl]methylidene}-1-ethyl-5-(morpholin-4-ylsulfonyl)-1,3-dihydro-2H-indol-2-one
Catalog ID
STL448646
SMILES CCN1C(=O)/C(=C\c2cn(c3c2cccc3)Cc2ccc(cc2Cl)Cl)/c2c1ccc(c2)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 C30H27Cl2N3O4S MW 596.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27Cl2N3O4S/c1-2-35-29-10-9-23(40(37,38)34-11-13-39-14-12-34)17-25(29)26(30(35)36)15-21-19-33(28-6-4-3-5-24(21)28)18-20-7-8-22(31)16-27(20)32/h3-10,15-17,19H,2,11-14,18H2,1H3/b26-15-InChIKey
BSZXFSHADVWIRX-YSMPRRRNSA-NSynonyms
(3Z)3((1((24DICHLOROPHENYL)METHYL)INDOL3YL)METHYLIDENE)1ETHYL5MORPHOLIN4YLSULFONYLINDOL2ONE
(3Z)3((1(24dichlorobenzyl)1Hindol3yl)methylidene)1ethyl5(morpholin4ylsulfonyl)13dihydro2Hindol2one
CCN1C(=O)C(=Cc2cn(c3c2cccc3)Cc2ccc(cc2Cl)Cl)c2c1ccc(c2)S(=O)(=O)N1CCOCC1
CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)C(=CC4=CN(C5=CC=CC=C54)CC6=C(C=C(C=C6)Cl)Cl)C1=O
InChI=1SC30H27Cl2N3O4Sc12352910923(40(3738)34111339141234)1725(29)26(30(35)36)15211933(28643524(21)28)18207822(31)1627(20)32h310151719H2111418H21H3b2615
MFCD05133753
ZINC000008778030
ZINC8778030
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