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)-(2,3,4-trimethoxyphenyl)methylidene]acetohydrazide
Catalog ID
STL036335
SMILES COc1c(OC)ccc(c1OC)/C=N\NC(=O)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 C29H30N4O5S2 MW 578.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N4O5S2/c1-17-9-12-19(13-10-17)33-28(35)24-20-7-5-6-8-22(20)40-27(24)31-29(33)39-16-23(34)32-30-15-18-11-14-21(36-2)26(38-4)25(18)37-3/h9-15H,5-8,16H2,1-4H3,(H,32,34)/b30-15-InChIKey
WWFMPDLSIUOBHT-MNDYBZJGSA-NSynonyms
(E)2((4oxo3(ptolyl)345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(234trimethoxybenzylidene)acetohydrazide
2((3(4methylphenyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N((Z)(234trimethoxyphenyl)methylidene)acetohydrazide
2((3(4methylphenyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N((Z)(234trimethoxyphenyl)methylideneamino)acetamide
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NN=CC4=C(C(=C(C=C4)OC)OC)OC)SC5=C3CCCC5
COc1c(OC)ccc(c1OC)C=NNC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCCC3
InChI=1SC29H30N4O5S2c11791219(131017)3328(35)2420756822(20)4027(24)3129(33)391623(34)32301518111421(362)26(384)25(18)373h915H5816H214H3(H3234)b3015
MFCD03217736
ZINC000100852506
ZINC2595891
Check stock
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Check stock on Vitas-MAvailable files
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