Vitas-M small molecule compound
methyl {[7-benzyl-3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Catalog ID
STK062207
SMILES COC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCN(C3)Cc1ccccc1
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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 C26H25N3O3S2 MW 491.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O3S2/c1-17-8-10-19(11-9-17)29-25(31)23-20-12-13-28(14-18-6-4-3-5-7-18)15-21(20)34-24(23)27-26(29)33-16-22(30)32-2/h3-11H,12-16H2,1-2H3InChIKey
IOEJIXHNBKEKFH-UHFFFAOYSA-NSynonyms
371929-35-0371929350
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)OC)SC4=C3CCN(C4)CC5=CC=CC=C5
COC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCN(C3)Cc1ccccc1
InChI=1SC26H25N3O3S2c11781019(11917)2925(31)2320121328(14186435718)1521(20)3424(23)2726(29)331622(30)322h311H1216H212H3
methyl((7benzyl3(4methylphenyl)4oxo345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetate
methyl2((7benzyl3(4methylphenyl)4oxo68dihydro5Hpyrido(23)thieno(24b)pyrimidin2yl)sulfanyl)acetate
methyl2((7benzyl4oxo3(ptolyl)345678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)thio)acetate
MFCD01561598
STK062207
ZINC000020827286
ZINC20827286
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