Vitas-M small molecule compound

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

Catalog ID
STK384836
SMILES CC1CCc2c(C1)sc1c2C(=NC(N1)c1cccc(c1Cl)Cl)O

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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 C17H16Cl2N2OS MW 367.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16Cl2N2OS/c1-8-5-6-9-12(7-8)23-17-13(9)16(22)20-15(21-17)10-3-2-4-11(18)14(10)19/h2-4,8,15,21H,5-7H2,1H3,(H,20,22)
InChIKey
FNZNYYBVSBPMCA-UHFFFAOYSA-N
Synonyms

2(23dichlorophenyl)7methyl125678hexahydro(1)benzothieno(23d)pyrimidin4ol
2(23dichlorophenyl)7methyl235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=C(C(=CC=C4)Cl)Cl
InChI=1SC17H16Cl2N2OSc1856912(78)231713(9)16(22)2015(2117)1032411(18)14(10)19h2481521H57H21H3(H2022)
MFCD11853300
ZINC000006468300
ZINC000006469150

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.