Vitas-M small molecule compound
2-(butylsulfanyl)-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Catalog ID
STK830544
SMILES CCCCSc1nc2sc3c(c2c(=O)n1CC=C)CCCC3
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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 C17H22N2OS2 MW 334.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2OS2/c1-3-5-11-21-17-18-15-14(16(20)19(17)10-4-2)12-8-6-7-9-13(12)22-15/h4H,2-3,5-11H2,1H3InChIKey
CXCVJMSXSSXHSS-UHFFFAOYSA-NSynonyms
324049-98-12(butylsulfanyl)3(prop2en1yl)5678tetrahydro(1)benzothieno(23d)pyrimidin4(3H)one
2butylsulfanyl3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin4one
324049981
3allyl2(butylthio)5678tetrahydrobenzo(45)thieno(23d)pyrimidin4(3H)one
CCCCSC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1CC=C
InChI=1SC17H22N2OS2c135112117181514(16(20)19(17)1042)12867913(12)2215h4H23511H21H3
MFCD01191364
ZINC000002230196
ZINC02230196
ZINC2230196
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