Vitas-M small molecule compound
8-(4-hydroxy-3,5-dimethoxyphenyl)-1-phenyl-6,8-dihydro-1H-imidazo[4,5-e][1,4]thiazepin-5-ol
Catalog ID
STL314810
SMILES COc1cc(cc(c1O)OC)C1SCC(=Nc2c1n(cn2)c1ccccc1)O
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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 C20H19N3O4S MW 397.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O4S/c1-26-14-8-12(9-15(27-2)18(14)25)19-17-20(22-16(24)10-28-19)21-11-23(17)13-6-4-3-5-7-13/h3-9,11,19,25H,10H2,1-2H3,(H,22,24)InChIKey
NAAOGFKWPJAVSX-UHFFFAOYSA-NSynonyms
1435998-84-71435998847
8(4hydroxy35dimethoxyphenyl)1phenyl48dihydroimidazo(45e)(14)thiazepin5one
8(4hydroxy35dimethoxyphenyl)1phenyl68dihydro1Himidazo(45e)(14)thiazepin5ol
COC1=CC(=CC(=C1O)OC)C2C3=C(NC(=O)CS2)N=CN3C4=CC=CC=C4
InChI=1SC20H19N3O4Sc12614812(915(272)18(14)25)191720(2216(24)102819)211123(17)136435713h39111925H10H212H3(H2224)
MFCD28026885
ZINC000095476592
ZINC000095476593
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