Vitas-M small molecule compound
8-[(4-methoxybenzyl)sulfanyl]-5-(2-methylpropyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Catalog ID
STK926083
SMILES COc1ccc(cc1)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)CC(C)C
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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 C25H27N3OS2 MW 449.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3OS2/c1-15(2)12-20-18-6-4-5-7-19(18)21-22-23(31-24(21)28-20)25(27-14-26-22)30-13-16-8-10-17(29-3)11-9-16/h8-11,14-15H,4-7,12-13H2,1-3H3InChIKey
MKBIMZZGGJKQOO-UHFFFAOYSA-NSynonyms
500146-31-6500146316
5isobutyl8((4methoxybenzyl)thio)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
8((4methoxybenzyl)sulfanyl)5(2methylpropyl)1234tetrahydropyrimido(4545)thieno(23c)isoquinoline
CC(C)CC1=C2CCCCC2=C3C4=C(C(=NC=N4)SCC5=CC=C(C=C5)OC)SC3=N1
InChI=1SC25H27N3OS2c115(2)122018645719(18)212223(3124(21)2820)25(27142622)30131681017(293)11916h8111415H471213H213H3
MFCD03304563
ZINC000001800676
ZINC01800676
ZINC1800676
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