Vitas-M small molecule compound
4-(3,4-dimethoxyphenyl)-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-3,4-dihydropyrimidine-2(1H)-thione
Catalog ID
STL337924
SMILES COc1cc(ccc1OC)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 C22H28N2O2S MW 384.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O2S/c1-25-18-4-3-16(8-19(18)26-2)17-9-20(24-21(27)23-17)22-10-13-5-14(11-22)7-15(6-13)12-22/h3-4,8-9,13-15,17H,5-7,10-12H2,1-2H3,(H2,23,24,27)InChIKey
KSBVQEPZDQFNNV-UHFFFAOYSA-NSynonyms
667908-64-74(34dimethoxyphenyl)6(tricyclo(3311~37~)dec1yl)34dihydropyrimidine2(1H)thione
6((3r5r7r)adamantan1yl)4(34dimethoxyphenyl)34dihydropyrimidine2(1H)thione
6(1adamantyl)4(34dimethoxyphenyl)34dihydro1Hpyrimidine2thione
6(1ADAMANTYL)4(34DIMETHOXYPHENYL)34DIHYDRO2(1H)PYRIMIDINETHIONE
667908647
COC1=C(C=C(C=C1)C2C=C(NC(=S)N2)C34CC5CC(C3)CC(C5)C4)OC
InChI=1SC22H28N2O2Sc125184316(819(18)262)17920(2421(27)2317)221013514(1122)715(613)1222h3489131517H571012H212H3(H2232427)
ZINC000008691613
ZINC000008691614
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