Vitas-M small molecule compound
4-{[(E)-(2,4-dichlorophenyl)methylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL050301
SMILES Clc1ccc(c(c1)Cl)/C=N/n1c(S)nnc1c1[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/c16-9-5-4-8(11(17)6-9)7-18-23-14(21-22-15(23)24)13-10-2-1-3-12(10)19-20-13/h4-7H,1-3H2,(H,19,20)(H,22,24)/b18-7+InChIKey
FVNBBCZSWFKSGW-CNHKJKLMSA-NSynonyms
(E)4((24dichlorobenzylidene)amino)5(1456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazole3thiol
4(((E)(24dichlorophenyl)methylidene)amino)5(2456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazole3thiol
4((1E)2(24DICHLOROPHENYL)1AZAVINYL)5(456TRIHYDROCYCLOPENTA(21D)PYRAZOL3YL)124TRIAZOLE3THIOL
4((E)(24dichlorophenyl)methylideneamino)3(1456tetrahydrocyclopenta(c)pyrazol3yl)1H124triazole5thione
C1CC2=C(C1)NN=C2C3=NNC(=S)N3N=CC4=C(C=C(C=C4)Cl)Cl
Clc1ccc(c(c1)Cl)C=Nn1c(S)nnc1c1(nH)nc2c1CCC2
Clc1ccc(c(c1)Cl)C=Nn1c(S)nnc1c1n(nH)c2c1CCC2
InChI=1SC15H12Cl2N6Sc169548(11(17)69)7182314(212215(23)24)131021312(10)192013h47H13H2(H1920)(H2224)b187+
MFCD05731360
ZINC000005626213
ZINC1270427
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