Vitas-M small molecule compound
5-(4-ethoxy-3-methoxyphenyl)-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-5,6-dihydro-7H-[1,2,4]triazolo[5,1-b][1,3]thiazin-7-one
Catalog ID
STL031949
SMILES CCOc1ccc(cc1OC)C1CC(=O)n2c(S1)nc(n2)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 C24H29N3O3S MW 439.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O3S/c1-3-30-18-5-4-17(9-19(18)29-2)20-10-21(28)27-23(31-20)25-22(26-27)24-11-14-6-15(12-24)8-16(7-14)13-24/h4-5,9,14-16,20H,3,6-8,10-13H2,1-2H3InChIKey
HXURILCBOQNDPH-UHFFFAOYSA-NSynonyms
433329-10-32((3r5r7r)adamantan1yl)5(4ethoxy3methoxyphenyl)5H(124)triazolo(51b)(13)thiazin7(6H)one
2(1ADAMANTYL)5(4ETHOXY3METHOXYPHENYL)56DIHYDRO(124)TRIAZOLO(51B)(13)THIAZIN7ONE
2(1ADAMANTYL)5(4ETHOXY3METHOXYPHENYL)56DIHYDRO7H(124)TRIAZOLO(51B)(13)THIAZIN7ONE
2ADAMANTANYL5(4ETHOXY3METHOXYPHENYL)5H6H124TRIAZOLO(51B)13THIAZAPERHYDROIN7ONE
433329103
5(4ethoxy3methoxyphenyl)2(tricyclo(3311~37~)dec1yl)56dihydro7H(124)triazolo(51b)(13)thiazin7one
CCOC1=C(C=C(C=C1)C2CC(=O)N3C(=NC(=N3)C45CC6CC(C4)CC(C6)C5)S2)OC
InChI=1SC24H29N3O3Sc1330185417(919(18)292)201021(28)2723(3120)2522(2627)241114615(1224)816(714)1324h459141620H3681013H212H3
MFCD03134482
ZINC000008829803
ZINC000008829804
Check stock
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Check stock on Vitas-MAvailable files
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