Vitas-M small molecule compound
8-(azepan-1-yl)-7-(4-methoxybenzyl)-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazin-6-one
Catalog ID
STK585584
SMILES COc1ccc(cc1)Cc1c(nc2n(c1=O)CCCS2)N1CCCCCC1
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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 C21H27N3O2S MW 385.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O2S/c1-26-17-9-7-16(8-10-17)15-18-19(23-11-4-2-3-5-12-23)22-21-24(20(18)25)13-6-14-27-21/h7-10H,2-6,11-15H2,1H3InChIKey
PGXMQAKHDXJLPR-UHFFFAOYSA-NSynonyms
900878-39-98(AZEPAN1YL)7((4METHOXYPHENYL)METHYL)34DIHYDRO2HPYRIMIDO(21B)(13)THIAZIN6ONE
8(azepan1yl)7(4methoxybenzyl)34dihydro2H6Hpyrimido(21b)(13)thiazin6one
8(azepan1yl)7(4methoxybenzyl)34dihydropyrimido(21b)(13)thiazin6(2H)one
900878399
COC1=CC=C(C=C1)CC2=C(N=C3N(C2=O)CCCS3)N4CCCCCC4
InChI=1SC21H27N3O2Sc126179716(81017)151819(231142351223)222124(20(18)25)136142721h710H261115H21H3
MFCD06776089
ZINC000005267102
ZINC05267102
ZINC5267102
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