Vitas-M small molecule compound
1-(4-bromobenzyl)-4-imino-6,6-dimethyl-1,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2-thiol
Catalog ID
STK629088
SMILES Brc1ccc(cc1)Cn1c(S)nc(=N)c2c1sc1c2CC(OC1)(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 C18H18BrN3OS2 MW 436.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrN3OS2/c1-18(2)7-12-13(9-23-18)25-16-14(12)15(20)21-17(24)22(16)8-10-3-5-11(19)6-4-10/h3-6H,7-9H2,1-2H3,(H2,20,21,24)InChIKey
BQAFOLTWQITHBF-UHFFFAOYSA-NSynonyms
861638-24-61(4bromobenzyl)4imino66dimethyl1568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidine2thiol
4amino1((4bromophenyl)methyl)66dimethyl58dihydropyrano(23)thieno(24b)pyrimidine2thione
861638246
CC1(CC2=C(CO1)SC3=C2C(=NC(=S)N3CC4=CC=C(C=C4)Br)N)C
InChI=1SC18H18BrN3OS2c118(2)71213(92318)251614(12)15(20)2117(24)22(16)8103511(19)6410h36H79H212H3(H2202124)
MFCD09792783
ZINC000013865264
ZINC13865264
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