Vitas-M small molecule compound
3-{[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}propanenitrile
Catalog ID
STK369262
SMILES N#CCCSc1nc2sc3c(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 C16H17N3OS2 MW 331.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3OS2/c1-2-9-19-15(20)13-11-6-3-4-7-12(11)22-14(13)18-16(19)21-10-5-8-17/h2H,1,3-7,9-10H2InChIKey
KBIIKDQXVXPNOW-UHFFFAOYSA-NSynonyms
294653-96-6294653966
3((4oxo3(prop2en1yl)345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)propanenitrile
3((4oxo3prop2enyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)propanenitrile
C=CCN1C(=O)C2=C(N=C1SCCC#N)SC3=C2CCCC3
InChI=1SC16H17N3OS2c1291915(20)1311634712(11)2214(13)1816(19)21105817h2H137910H2
MFCD00402039
ZINC000003150354
ZINC03150354
ZINC3150354
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