Vitas-M small molecule compound
4-(3,4-dimethoxyphenyl)-2,5-dihydro-1H-2,3-benzodiazepine-1-thione
Catalog ID
STK927827
SMILES COc1cc(ccc1OC)C1=NNC(=S)c2c(C1)cccc2
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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 C17H16N2O2S MW 312.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O2S/c1-20-15-8-7-12(10-16(15)21-2)14-9-11-5-3-4-6-13(11)17(22)19-18-14/h3-8,10H,9H2,1-2H3,(H,19,22)InChIKey
CFLXTYGEEKIZQM-UHFFFAOYSA-NSynonyms
4(34dimethoxyphenyl)25dihydro1H23benzodiazepine1thione
4(34dimethoxyphenyl)25dihydro23benzodiazepine1thione
COC1=C(C=C(C=C1)C2=NNC(=S)C3=CC=CC=C3C2)OC
InChI=1SC17H16N2O2Sc120158712(1016(15)212)14911534613(11)17(22)191814h3810H9H212H3(H1922)
MFCD13704408
ZINC000040545088
ZINC40545088
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