Vitas-M small molecule compound
4-{[(E)-(2,3-dichlorophenyl)methylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL052573
SMILES Sc1nnc(n1/N=C/c1cccc(c1Cl)Cl)c1[nH]nc2c1CCC2
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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 C15H12Cl2N6S MW 379.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12Cl2N6S/c16-10-5-1-3-8(12(10)17)7-18-23-14(21-22-15(23)24)13-9-4-2-6-11(9)19-20-13/h1,3,5,7H,2,4,6H2,(H,19,20)(H,22,24)/b18-7+InChIKey
OVRWLQUUWDJLBY-CNHKJKLMSA-NSynonyms
(E)4((23dichlorobenzylidene)amino)5(1456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazole3thiol
4(((E)(23dichlorophenyl)methylidene)amino)5(2456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazole3thiol
4((1E)2(23DICHLOROPHENYL)1AZAVINYL)5(456TRIHYDROCYCLOPENTA(21D)PYRAZOL3YL)124TRIAZOLE3THIOL
4((E)(23dichlorophenyl)methylideneamino)3(1456tetrahydrocyclopenta(c)pyrazol3yl)1H124triazole5thione
C1CC2=C(C1)NN=C2C3=NNC(=S)N3N=CC4=C(C(=CC=C4)Cl)Cl
InChI=1SC15H12Cl2N6Sc16105138(12(10)17)7182314(212215(23)24)13942611(9)192013h1357H246H2(H1920)(H2224)b187+
MFCD05733274
Sc1nnc(n1N=Cc1cccc(c1Cl)Cl)c1(nH)nc2c1CCC2
Sc1nnc(n1N=Cc1cccc(c1Cl)Cl)c1n(nH)c2c1CCC2
ZINC000009358624
ZINC33932685
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