Vitas-M small molecule compound
1-(3-bromophenyl)-8-(3-hydroxy-4-methoxyphenyl)-6,8-dihydro-1H-imidazo[4,5-e][1,4]thiazepin-5-ol
Catalog ID
STL320217
SMILES COc1ccc(cc1O)C1SCC(=Nc2c1n(cn2)c1cccc(c1)Br)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 C19H16BrN3O3S MW 446.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrN3O3S/c1-26-15-6-5-11(7-14(15)24)18-17-19(22-16(25)9-27-18)21-10-23(17)13-4-2-3-12(20)8-13/h2-8,10,18,24H,9H2,1H3,(H,22,25)InChIKey
UHVSHKWNNHBDKP-UHFFFAOYSA-NSynonyms
1435980-10-11(3bromophenyl)8(3hydroxy4methoxyphenyl)48dihydroimidazo(45e)(14)thiazepin5one
1(3bromophenyl)8(3hydroxy4methoxyphenyl)68dihydro1Himidazo(45e)(14)thiazepin5ol
1435980101
COC1=C(C=C(C=C1)C2C3=C(NC(=O)CS2)N=CN3C4=CC(=CC=C4)Br)O
InChI=1SC19H16BrN3O3Sc126156511(714(15)24)181719(2216(25)92718)211023(17)1342312(20)813h28101824H9H21H3(H2225)
MFCD28029369
ZINC000095480647
ZINC000095480648
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