Vitas-M small molecule compound
N'-[(E)-(4-tert-butylphenyl)methylidene]-2-[(4-oxo-3-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetohydrazide
Catalog ID
STL307935
SMILES O=C(CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3)N/N=C/c1ccc(cc1)C(C)(C)C
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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 C29H30N4O2S2 MW 530.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N4O2S2/c1-29(2,3)20-15-13-19(14-16-20)17-30-32-24(34)18-36-28-31-26-25(22-11-7-8-12-23(22)37-26)27(35)33(28)21-9-5-4-6-10-21/h4-6,9-10,13-17H,7-8,11-12,18H2,1-3H3,(H,32,34)/b30-17+InChIKey
SELYUSHZMGTDTL-OCSSWDANSA-NSynonyms
497168-28-2(E)N(4(tertbutyl)benzylidene)2((4oxo3phenyl345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetohydrazide
497168282
CC(C)(C)C1=CC=C(C=C1)C=NNC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2C5=CC=CC=C5
InChI=1SC29H30N4O2S2c129(23)20151319(141620)17303224(34)183628312625(2211781223(22)3726)27(35)33(28)2195461021h469101317H78111218H213H3(H3234)b3017+
MFCD03222332
N((E)(4tertbutylphenyl)methylidene)2((4oxo3phenyl345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetohydrazide
N((E)(4tertbutylphenyl)methylideneamino)2((4oxo3phenyl5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
O=C(CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCC3)NN=Cc1ccc(cc1)C(C)(C)C
ZINC000002229218
ZINC101422208
Check stock
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Check stock on Vitas-MAvailable files
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