Vitas-M small molecule compound
2-{[3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N'-[(Z)-(1-methyl-1H-pyrrol-2-yl)methylidene]acetohydrazide
Catalog ID
STK125164
SMILES O=C(CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCCC3)N/N=C\c1cccn1C
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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 C25H25N5O2S2 MW 491.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O2S2/c1-16-9-11-17(12-10-16)30-24(32)22-19-7-3-4-8-20(19)34-23(22)27-25(30)33-15-21(31)28-26-14-18-6-5-13-29(18)2/h5-6,9-14H,3-4,7-8,15H2,1-2H3,(H,28,31)/b26-14-InChIKey
YTNKMPRHSZNCBY-WGARJPEWSA-NSynonyms
(E)N((1methyl1Hpyrrol2yl)methylene)2((4oxo3(ptolyl)345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetohydrazide
2((3(4methylphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N((Z)(1methyl1Hpyrrol2yl)methylidene)acetohydrazide
2((3(4methylphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N((Z)(1methylpyrrol2yl)methylideneamino)acetamide
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NN=CC4=CC=CN4C)SC5=C3CCCC5
InChI=1SC25H25N5O2S2c11691117(121016)3024(32)2219734820(19)3423(22)2725(30)331521(31)28261418651329(18)2h56914H347815H212H3(H2831)b2614
MFCD03217698
O=C(CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCCC3)NN=Cc1cccn1C
ZINC000030759536
ZINC09088586
ZINC9088586
Check stock
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Check stock on Vitas-MAvailable files
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