Vitas-M small molecule compound
4-({[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Catalog ID
STK844790
SMILES N#Cc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)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 C25H21N3OS2 MW 443.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3OS2/c1-16-6-12-19(13-7-16)28-24(29)22-20-4-2-3-5-21(20)31-23(22)27-25(28)30-15-18-10-8-17(14-26)9-11-18/h6-13H,2-5,15H2,1H3InChIKey
UIUYURTYOATAQH-UHFFFAOYSA-NSynonyms
678561-50-74(((3(4methylphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)methyl)benzonitrile
4(((4oxo3(ptolyl)345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)methyl)benzonitrile
4((3(4methylphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanylmethyl)benzonitrile
678561507
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC4=CC=C(C=C4)C#N)SC5=C3CCCC5
InChI=1SC25H21N3OS2c11661219(13716)2824(29)2220423521(20)3123(22)2725(28)30151810817(1426)91118h613H2515H21H3
MFCD03474265
ZINC000002258471
ZINC02258471
ZINC2258471
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