Vitas-M small molecule compound
diethyl 1,1'-(7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2,4-diyl)bis(5-amino-1H-pyrazole-4-carboxylate)
Catalog ID
STK549284
SMILES CCOC(=O)c1cnn(c1N)c1nc2sc3c(c2c(n1)n1ncc(c1N)C(=O)OCC)CCC(C3)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 C23H26N8O4S MW 510.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N8O4S/c1-4-34-21(32)13-9-26-30(17(13)24)19-16-12-7-6-11(3)8-15(12)36-20(16)29-23(28-19)31-18(25)14(10-27-31)22(33)35-5-2/h9-11H,4-8,24-25H2,1-3H3InChIKey
PXJKIKRMFKWNLJ-UHFFFAOYSA-NSynonyms
1009186-08-61009186086
CCOC(=O)C1=C(N(N=C1)C2=C3C4=C(CC(CC4)C)SC3=NC(=N2)N5C(=C(C=N5)C(=O)OCC)N)N
diethyl11(7methyl5678tetrahydro(1)benzothieno(23d)pyrimidine24diyl)bis(5amino1Hpyrazole4carboxylate)
diethyl11(7methyl5678tetrahydrobenzo(45)thieno(23d)pyrimidine24diyl)bis(5amino1Hpyrazole4carboxylate)
ethyl5amino1(2(5amino4ethoxycarbonylpyrazol1yl)7methyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4yl)pyrazole4carboxylate
InChI=1SC23H26N8O4Sc143421(32)1392630(17(13)24)1916127611(3)815(12)3620(16)2923(2819)3118(25)14(102731)22(33)3552h911H482425H213H3
MFCD03691602
ZINC000002253304
ZINC000002253305
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