Vitas-M small molecule compound
(8E)-8-(2,4-dimethoxybenzylidene)-4-(2,4-dimethoxyphenyl)-2-(methylsulfanyl)-3,4,5,6,7,8-hexahydroquinazoline
Catalog ID
STL115136
SMILES COc1ccc(c(c1)OC)/C=C/1\CCCC2=C1N=C(SC)NC2c1ccc(cc1OC)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 C26H30N2O4S MW 466.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O4S/c1-29-18-10-9-16(22(14-18)31-3)13-17-7-6-8-21-24(17)27-26(33-5)28-25(21)20-12-11-19(30-2)15-23(20)32-4/h9-15,25H,6-8H2,1-5H3,(H,27,28)/b17-13+InChIKey
QUZWBUFLWFEYCL-GHRIWEEISA-NSynonyms
(8E)4(24dimethoxyphenyl)8((24dimethoxyphenyl)methylidene)2methylsulfanyl4567tetrahydro1Hquinazoline
(8E)8(24dimethoxybenzylidene)4(24dimethoxyphenyl)2(methylsulfanyl)345678hexahydroquinazoline
COC1=CC(=C(C=C1)C=C2CCCC3=C2NC(=NC3C4=C(C=C(C=C4)OC)OC)SC)OC
COc1ccc(c(c1)OC)C=C1CCCC2=C1N=C(SC)NC2c1ccc(cc1OC)OC
InChI=1SC26H30N2O4Sc1291810916(22(1418)313)13177682124(17)2726(335)2825(21)20121119(302)1523(20)324h91525H68H215H3(H2728)b1713+
MFCD03177093
ZINC000102901854
ZINC000102901856
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