Vitas-M small molecule compound

4-{[(E)-(9-ethyl-9H-carbazol-3-yl)methylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STL050202
SMILES CCn1c2ccc(cc2c2c1cccc2)/C=N/n1c(S)nnc1c1n[nH]c(c1)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 C21H19N7S MW 401.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N7S/c1-3-27-18-7-5-4-6-15(18)16-11-14(8-9-19(16)27)12-22-28-20(25-26-21(28)29)17-10-13(2)23-24-17/h4-12H,3H2,1-2H3,(H,23,24)(H,26,29)/b22-12+
InChIKey
CPRYOLMVLYEMHD-WSDLNYQXSA-N
Synonyms
1035964-40-9
(E)4(((9ethyl9Hcarbazol3yl)methylene)amino)5(3methyl1Hpyrazol5yl)4H124triazole3thiol
1035964409
4(((E)(9ethyl9Hcarbazol3yl)methylidene)amino)5(5methyl1Hpyrazol3yl)4H124triazole3thiol
4((1(9ETHYL9HCARBAZOL3YL)METH(E)YLIDENE)AMINO)5(5METHYL2HPYRAZOL3YL)4H(124)TRIAZOLE3THIOL
4((1E)2(9ETHYLCARBAZOL3YL)1AZAVINYL)5(3METHYLPYRAZOL5YL)124TRIAZOLE3THIOL
4((E)(9ETHYL3CARBAZOLYL)METHYLIDENEAMINO)3(5METHYL1HPYRAZOL3YL)1H124TRIAZOLE5THIONE
4((E)(9ETHYLCARBAZOL3YL)METHYLENEAMINO)3(5METHYL1HPYRAZOL3YL)1H124TRIAZOLE5THIONE
4((E)(9ETHYLCARBAZOL3YL)METHYLIDENEAMINO)3(5METHYL1HPYRAZOL3YL)1H124TRIAZOLE5THIONE
CCN1C2=C(C=C(C=C2)C=NN3C(=NNC3=S)C4=NNC(=C4)C)C5=CC=CC=C51
CCn1c2ccc(cc2c2c1cccc2)C=Nn1c(S)nnc1c1(nH)nc(c1)C
CCn1c2ccc(cc2c2c1cccc2)C=Nn1c(S)nnc1c1n(nH)c(c1)C
InChI=1SC21H19N7Sc132718754615(18)161114(8919(16)27)12222820(252621(28)29)171013(2)232417h412H3H212H3(H2324)(H2629)b2212+
MFCD05727980
ZINC000006785934
ZINC15987597

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Available files

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