Vitas-M small molecule compound
4,8-bis(4-methoxyphenyl)-6-methyl-2-(prop-2-en-1-ylsulfanyl)-1,4,4a,5,6,7,7a,8-octahydrochromeno[3,2-i]quinazoline-11,12-diol
Catalog ID
STK681744
SMILES C=CCSC1=NC(c2ccc(cc2)OC)C2C3(N1)Oc1c(O)c(O)ccc1C(C3CC(C2)C)c1ccc(cc1)OC
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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 C33H36N2O5S MW 572.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H36N2O5S/c1-5-16-41-32-34-29(21-8-12-23(39-4)13-9-21)26-18-19(2)17-25-28(20-6-10-22(38-3)11-7-20)24-14-15-27(36)30(37)31(24)40-33(25,26)35-32/h5-15,19,25-26,28-29,36-37H,1,16-18H2,2-4H3,(H,34,35)InChIKey
IOTDTFACAVPCSM-UHFFFAOYSA-NSynonyms
48bis(4methoxyphenyl)6methyl2(prop2en1ylsulfanyl)144a5677a8octahydrochromeno(32i)quinazoline1112diol
CC1CC2C(C3=C(C(=C(C=C3)O)O)OC24C(C1)C(NC(=N4)SCC=C)C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC
InChI=1SC33H36N2O5Sc151641323429(2181223(394)13921)261819(2)172528(2061022(383)11720)24141527(36)30(37)31(24)4033(2526)3532h51519252628293637H11618H224H3(H3435)
MFCD03819816
ZINC000245255470
ZINC000245255473
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