Vitas-M small molecule compound
4-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK585102
SMILES COc1ccc(cc1OC)/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC(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 C20H22N4O3S MW 398.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O3S/c1-13(2)27-16-7-5-6-15(11-16)19-22-23-20(28)24(19)21-12-14-8-9-17(25-3)18(10-14)26-4/h5-13H,1-4H3,(H,23,28)/b21-12+InChIKey
YIQYYOUDEHOOOT-CIAFOILYSA-NSynonyms
678543-26-54(((E)(34dimethoxyphenyl)methylidene)amino)5(3(propan2yloxy)phenyl)24dihydro3H124triazole3thione
4((1E)2(34DIMETHOXYPHENYL)1AZAVINYL)5(3(METHYLETHOXY)PHENYL)124TRIAZOLE3THIOL
4((E)(34dimethoxyphenyl)methylideneamino)3(3propan2yloxyphenyl)1H124triazole5thione
678543265
CC(C)OC1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=CC(=C(C=C3)OC)OC
COc1ccc(cc1OC)C=Nn1c(=S)(nH)nc1c1cccc(c1)OC(C)C
InChI=1SC20H22N4O3Sc113(2)271675615(1116)19222320(28)24(19)2112148917(253)18(1014)264h513H14H3(H2328)b2112+
MFCD07206202
ZINC000016995593
ZINC33858817
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