Vitas-M small molecule compound
6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-4-(3,4,5-trimethoxyphenyl)-3,4-dihydropyrimidine-2(1H)-thione
Catalog ID
STL168740
SMILES COc1cc(cc(c1OC)OC)C1NC(=S)NC(=C1)C12CC3CC(C2)CC(C1)C3
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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 C23H30N2O3S MW 414.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N2O3S/c1-26-18-7-16(8-19(27-2)21(18)28-3)17-9-20(25-22(29)24-17)23-10-13-4-14(11-23)6-15(5-13)12-23/h7-9,13-15,17H,4-6,10-12H2,1-3H3,(H2,24,25,29)InChIKey
NBKOLADYUCUELK-UHFFFAOYSA-NSynonyms
724453-96-76(1ADAMANTYL)4(345TRIMETHOXYPHENYL)34DIHYDRO1HPYRIMIDINE2THIONE
6(1ADAMANTYL)4(345TRIMETHOXYPHENYL)34DIHYDRO2(1H)PYRIMIDINETHIONE
6(tricyclo(3311~37~)dec1yl)4(345trimethoxyphenyl)34dihydropyrimidine2(1H)thione
724453967
COC1=CC(=CC(=C1OC)OC)C2C=C(NC(=S)N2)C34CC5CC(C3)CC(C5)C4
InChI=1SC23H30N2O3Sc12618716(819(272)21(18)283)17920(2522(29)2417)231013414(1123)615(513)1223h79131517H461012H213H3(H2242529)
ZINC000008680958
ZINC000008680959
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