Vitas-M small molecule compound
2-ethoxy-4-(4-hydroxy-7-methyl-1,2,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)phenyl naphthalene-1-carboxylate
Catalog ID
STK746094
SMILES CCOc1cc(ccc1OC(=O)c1cccc2c1cccc2)C1N=C(O)c2c(N1)sc1c2CCN(C1)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 C29H27N3O4S MW 513.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N3O4S/c1-3-35-23-15-18(26-30-27(33)25-21-13-14-32(2)16-24(21)37-28(25)31-26)11-12-22(23)36-29(34)20-10-6-8-17-7-4-5-9-19(17)20/h4-12,15,26,31H,3,13-14,16H2,1-2H3,(H,30,33)InChIKey
QVJLCZKAJUYIHF-UHFFFAOYSA-NSynonyms
500196-27-0(2ethoxy4(7methyl4oxo123568hexahydropyrido(23)thieno(24d)pyrimidin2yl)phenyl)naphthalene1carboxylate
2ethoxy4(4hydroxy7methyl125678hexahydropyrido(4345)thieno(23d)pyrimidin2yl)phenylnaphthalene1carboxylate
500196270
CCOC1=C(C=CC(=C1)C2NC3=C(C4=C(S3)CN(CC4)C)C(=O)N2)OC(=O)C5=CC=CC6=CC=CC=C65
InChI=1SC29H27N3O4Sc1335231518(263027(33)2521131432(2)1624(21)3728(25)3126)111222(23)3629(34)20106817745919(17)20h412152631H3131416H212H3(H3033)
MFCD03793769
ZINC000002360877
ZINC000002360879
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