Vitas-M small molecule compound

2-(2,6-dichlorophenyl)-7-(2-methylbutan-2-yl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4-ol

Catalog ID
STK383129
SMILES CCC(C1CCc2c(C1)sc1c2C(=NC(N1)c1c(Cl)cccc1Cl)O)(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 C21H24Cl2N2OS MW 423.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24Cl2N2OS/c1-4-21(2,3)11-8-9-12-15(10-11)27-20-16(12)19(26)24-18(25-20)17-13(22)6-5-7-14(17)23/h5-7,11,18,25H,4,8-10H2,1-3H3,(H,24,26)
InChIKey
QEQZCJJONHWXCH-UHFFFAOYSA-N
Synonyms

2(26dichlorophenyl)7(2methylbutan2yl)125678hexahydro(1)benzothieno(23d)pyrimidin4ol
2(26dichlorophenyl)7(2methylbutan2yl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CCC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=C(C=CC=C4Cl)Cl
InChI=1SC21H24Cl2N2OSc1421(23)11891215(1011)272016(12)19(26)2418(2520)1713(22)65714(17)23h57111825H4810H213H3(H2426)
MFCD03103371
ZINC000004545734
ZINC000004545737

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Available files

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