Vitas-M small molecule compound
2-(benzylsulfanyl)-7-tert-butyl-3-(3-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK546406
SMILES Cc1cccc(c1)n1c(SCc2ccccc2)nc2c(c1=O)c1CCC(Cc1s2)C(C)(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 C28H30N2OS2 MW 474.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2OS2/c1-18-9-8-12-21(15-18)30-26(31)24-22-14-13-20(28(2,3)4)16-23(22)33-25(24)29-27(30)32-17-19-10-6-5-7-11-19/h5-12,15,20H,13-14,16-17H2,1-4H3InChIKey
YXXRPHMVGLFUFU-UHFFFAOYSA-NSynonyms
488854-83-72(benzylsulfanyl)7tertbutyl3(3methylphenyl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2(benzylthio)7(tertbutyl)3(mtolyl)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
2benzylsulfanyl7tertbutyl3(3methylphenyl)5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
488854837
CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC4=CC=CC=C4)SC5=C3CCC(C5)C(C)(C)C
InChI=1SC28H30N2OS2c118981221(1518)3026(31)2422141320(28(23)4)1623(22)3325(24)2927(30)321719106571119h5121520H13141617H214H3
MFCD03294914
ZINC000009272397
ZINC000013583084
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