Vitas-M small molecule compound
(1Z)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-4-[4-(morpholin-4-ylsulfonyl)phenyl]butan-2-one
Catalog ID
STK583002
SMILES COc1cc2/C(=C/C(=O)CCc3ccc(cc3)S(=O)(=O)N3CCOCC3)/NCCc2cc1OC
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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 C25H30N2O6S MW 486.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O6S/c1-31-24-15-19-9-10-26-23(22(19)17-25(24)32-2)16-20(28)6-3-18-4-7-21(8-5-18)34(29,30)27-11-13-33-14-12-27/h4-5,7-8,15-17,26H,3,6,9-14H2,1-2H3/b23-16-InChIKey
KHYAZZWNQORLIH-KQWNVCNZSA-NSynonyms
904209-72-9(1Z)1(67dimethoxy34dihydro2Hisoquinolin1ylidene)4(4morpholin4ylsulfonylphenyl)butan2one
(1Z)1(67dimethoxy34dihydroisoquinolin1(2H)ylidene)4(4(morpholin4ylsulfonyl)phenyl)butan2one
(Z)1(67dimethoxy34dihydroisoquinolin1(2H)ylidene)4(4(morpholinosulfonyl)phenyl)butan2one
904209729
COC1=C(C=C2C(=C1)CCNC2=CC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)OC
COc1cc2C(=CC(=O)CCc3ccc(cc3)S(=O)(=O)N3CCOCC3)NCCc2cc1OC
InChI=1SC25H30N2O6Sc1312415199102623(22(19)1725(24)322)1620(28)63184721(8518)34(2930)27111333141227h4578151726H36914H212H3b2316
MFCD07639352
ZINC000013591159
ZINC13591159
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