Vitas-M small molecule compound
8-tert-butyl-1-[(3,4-dichlorobenzyl)sulfanyl]-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Catalog ID
STK722372
SMILES Clc1cc(ccc1Cl)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCC(C3)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 C28H26Cl2N4OS2 MW 569.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26Cl2N4OS2/c1-28(2,3)17-10-11-19-22(14-17)37-25-23(19)24(35)33(18-7-5-4-6-8-18)26-31-32-27(34(25)26)36-15-16-9-12-20(29)21(30)13-16/h4-9,12-13,17H,10-11,14-15H2,1-3H3InChIKey
HVQYLMLGIDRMTK-UHFFFAOYSA-NSynonyms
351161-28-9351161289
8(tertbutyl)1((34dichlorobenzyl)thio)4phenyl6789tetrahydrobenzo(45)thieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
8tertbutyl1((34dichlorobenzyl)sulfanyl)4phenyl6789tetrahydro(1)benzothieno(32e)(124)triazolo(43a)pyrimidin5(4H)one
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C4=NN=C(N34)SCC5=CC(=C(C=C5)Cl)Cl)C6=CC=CC=C6
InChI=1SC28H26Cl2N4OS2c128(23)1710111922(1417)372523(19)24(35)33(187546818)26313227(34(25)26)36151691220(29)21(30)1316h49121317H10111415H213H3
MFCD01951706
ZINC000001900630
ZINC000001900631
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