Vitas-M small molecule compound

7-methyl-2-(4-methylphenyl)-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

Catalog ID
STK382112
SMILES CC1CCc2c(C1)sc1c2C(=O)NC(N1)c1ccc(cc1)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 C18H20N2OS MW 312.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N2OS/c1-10-3-6-12(7-4-10)16-19-17(21)15-13-8-5-11(2)9-14(13)22-18(15)20-16/h3-4,6-7,11,16,20H,5,8-9H2,1-2H3,(H,19,21)
InChIKey
ZPLGHHKDFSJMIF-UHFFFAOYSA-N
Synonyms

7methyl2(4methylphenyl)235678hexahydro(1)benzothieno(23d)pyrimidin4(1H)one
7methyl2(4methylphenyl)235678hexahydro1H(1)benzothiolo(23d)pyrimidin4one
CC1CCC2=C(C1)SC3=C2C(=O)NC(N3)C4=CC=C(C=C4)C
InChI=1SC18H20N2OSc1103612(7410)161917(21)15138511(2)914(13)2218(15)2016h3467111620H589H212H3(H1921)
MFCD02915424
ZINC000004543292
ZINC000004543295

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Available files

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