Vitas-M small molecule compound
4-{[(E)-(4-tert-butylphenyl)methylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK572753
SMILES CC(Oc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)C(C)(C)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 C22H26N4OS MW 394.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4OS/c1-15(2)27-19-8-6-7-17(13-19)20-24-25-21(28)26(20)23-14-16-9-11-18(12-10-16)22(3,4)5/h6-15H,1-5H3,(H,25,28)/b23-14+InChIKey
JCSJNOJHOWFMNN-OEAKJJBVSA-NSynonyms
677293-94-64(((E)(4tertbutylphenyl)methylidene)amino)5(3(propan2yloxy)phenyl)24dihydro3H124triazole3thione
4((1E)2(4(TERTBUTYL)PHENYL)1AZAVINYL)5(3(METHYLETHOXY)PHENYL)124TRIAZOLE3THIOL
4((E)(4tertbutylphenyl)methylideneamino)3(3propan2yloxyphenyl)1H124triazole5thione
677293946
CC(C)OC1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=CC=C(C=C3)C(C)(C)C
CC(Oc1cccc(c1)c1n(nH)c(=S)n1N=Cc1ccc(cc1)C(C)(C)C)C
InChI=1SC22H26N4OSc115(2)271986717(1319)20242521(28)26(20)23141691118(121016)22(34)5h615H15H3(H2528)b2314+
MFCD07208322
ZINC000005859390
ZINC33365832
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