Vitas-M small molecule compound
5-[3-(propan-2-yloxy)phenyl]-4-{[(E)-(4-propoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK575704
SMILES CCCOc1ccc(cc1)/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 C21H24N4O2S MW 396.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O2S/c1-4-12-26-18-10-8-16(9-11-18)14-22-25-20(23-24-21(25)28)17-6-5-7-19(13-17)27-15(2)3/h5-11,13-15H,4,12H2,1-3H3,(H,24,28)/b22-14+InChIKey
MAXDBOUDHLQZJV-HYARGMPZSA-NSynonyms
577981-91-03(3PROPAN2YLOXYPHENYL)4((E)(4PROPOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
4((1E)2(4PROPOXYPHENYL)1AZAVINYL)5(3(METHYLETHOXY)PHENYL)124TRIAZOLE3THIOL
5(3(propan2yloxy)phenyl)4(((E)(4propoxyphenyl)methylidene)amino)24dihydro3H124triazole3thione
577981910
CCCOC1=CC=C(C=C1)C=NN2C(=NNC2=S)C3=CC(=CC=C3)OC(C)C
CCCOc1ccc(cc1)C=Nn1c(=S)(nH)nc1c1cccc(c1)OC(C)C
InChI=1SC21H24N4O2Sc1412261810816(91118)14222520(232421(25)28)1765719(1317)2715(2)3h5111315H412H213H3(H2428)b2214+
MFCD07212654
ZINC000005738390
ZINC2323414
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