Vitas-M small molecule compound
5-(5-methyl-1H-pyrazol-3-yl)-4-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL054725
SMILES Cc1[nH]nc(c1)c1nnc(n1/N=C/c1ccc(cc1)C(C)C)S
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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 C16H18N6S MW 326.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N6S/c1-10(2)13-6-4-12(5-7-13)9-17-22-15(20-21-16(22)23)14-8-11(3)18-19-14/h4-10H,1-3H3,(H,18,19)(H,21,23)/b17-9+InChIKey
DQRGQUPSCNUVCX-RQZCQDPDSA-NSynonyms
1037569-48-4(E)4((4isopropylbenzylidene)amino)5(3methyl1Hpyrazol5yl)4H124triazole3thiol
1037569484
3(5METHYL1HPYRAZOL3YL)4((E)(4PROPAN2YLPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
5(5methyl1Hpyrazol3yl)4(((E)(4(propan2yl)phenyl)methylidene)amino)4H124triazole3thiol
Cc1(nH)nc(c1)c1nnc(n1N=Cc1ccc(cc1)C(C)C)S
CC1=CC(=NN1)C2=NNC(=S)N2N=CC3=CC=C(C=C3)C(C)C
Cc1n(nH)c(c1)c1nnc(n1N=Cc1ccc(cc1)C(C)C)S
InChI=1SC16H18N6Sc110(2)136412(5713)9172215(202116(22)23)14811(3)181914h410H13H3(H1819)(H2123)b179+
MFCD05731659
ZINC000006786166
ZINC2604876
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