Vitas-M small molecule compound

4-{[(E)-furan-2-ylmethylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK585763
SMILES CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccco1)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 C16H16N4O2S MW 328.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O2S/c1-11(2)22-13-6-3-5-12(9-13)15-18-19-16(23)20(15)17-10-14-7-4-8-21-14/h3-11H,1-2H3,(H,19,23)/b17-10+
InChIKey
HHVHFGNGZKHSKT-LICLKQGHSA-N
Synonyms
573944-76-0
4(((E)furan2ylmethylidene)amino)5(3(propan2yloxy)phenyl)24dihydro3H124triazole3thione
4((1E)2(2FURYL)1AZAVINYL)5(3(METHYLETHOXY)PHENYL)124TRIAZOLE3THIOL
4((E)FURAN2YLMETHYLIDENEAMINO)3(3PROPAN2YLOXYPHENYL)1H124TRIAZOLE5THIONE
4((FURAN2YLMETHYLENE)AMINO)5(3ISOPROPOXYPHENYL)4H124TRIAZOLE3THIOL
573944760
CC(C)OC1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=CC=CO3
CC(Oc1cccc(c1)c1n(nH)c(=S)n1N=Cc1ccco1)C
InChI=1SC16H16N4O2Sc111(2)221363512(913)15181916(23)20(15)1710147482114h311H12H3(H1923)b1710+
MFCD07210332
ZINC000005817438
ZINC33323630

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Available files

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