Vitas-M small molecule compound
4-(4-methoxyphenyl)-6-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-3,4-dihydropyrimidine-2(1H)-thione
Catalog ID
STK723215
SMILES COc1ccc(cc1)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 C21H26N2OS MW 354.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2OS/c1-24-17-4-2-16(3-5-17)18-9-19(23-20(25)22-18)21-10-13-6-14(11-21)8-15(7-13)12-21/h2-5,9,13-15,18H,6-8,10-12H2,1H3,(H2,22,23,25)InChIKey
TUPASQKQKKXVLR-UHFFFAOYSA-NSynonyms
675830-09-84(4methoxyphenyl)6(tricyclo(3311~37~)dec1yl)34dihydropyrimidine2(1H)thione
6((3r5r7r)adamantan1yl)4(4methoxyphenyl)34dihydropyrimidine2(1H)thione
6(1ADAMANTYL)4(4METHOXYPHENYL)34DIHYDRO1HPYRIMIDINE2THIONE
675830098
6ADAMANTAN1YL4(4METHOXYPHENYL)34DIHYDRO1HPYRIMIDINE2THIONE
COC1=CC=C(C=C1)C2C=C(NC(=S)N2)C34CC5CC(C3)CC(C5)C4
InChI=1SC21H26N2OSc124174216(3517)18919(2320(25)2218)211013614(1121)815(713)1221h259131518H681012H21H3(H2222325)
MFCD04050639
ZINC000008830135
ZINC000008830136
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