Vitas-M small molecule compound

7-tert-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one

Catalog ID
STK831008
SMILES C=CCn1c(SCC(=O)c2ccccc2)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 C25H28N2O2S2 MW 452.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O2S2/c1-5-13-27-23(29)21-18-12-11-17(25(2,3)4)14-20(18)31-22(21)26-24(27)30-15-19(28)16-9-7-6-8-10-16/h5-10,17H,1,11-15H2,2-4H3
InChIKey
ZMVFRHBYIHNIDG-UHFFFAOYSA-N
Synonyms
372182-98-4
372182984
3allyl7(tertbutyl)2((2oxo2phenylethyl)thio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
7tertbutyl2((2oxo2phenylethyl)sulfanyl)3(prop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
7tertbutyl2phenacylsulfanyl3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)C4=CC=CC=C4)CC=C
InChI=1SC25H28N2O2S2c15132723(29)2118121117(25(23)4)1420(18)3122(21)2624(27)301519(28)1697681016h51017H11115H224H3
MFCD01880544
ZINC000002275863
ZINC000002275864

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Available files

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