Vitas-M small molecule compound

3-[4-(4-chlorophenyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazol-3-yl]pyridine

Catalog ID
STL042803
SMILES Clc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1c1cccnc1

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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 C22H17ClN4S MW 404.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN4S/c23-19-10-12-20(13-11-19)27-21(18-9-4-14-24-16-18)25-26-22(27)28-15-5-8-17-6-2-1-3-7-17/h1-14,16H,15H2/b8-5+
InChIKey
VDUUMTSSSCKCBH-VMPITWQZSA-N
Synonyms
1164525-98-7
(E)3(4(4chlorophenyl)5(cinnamylthio)4H124triazol3yl)pyridine
1164525987
3((2E)3PHENYLPROP2ENYLTHIO)4(4CHLOROPHENYL)5(3PYRIDYL)124TRIAZOLE
3(4(4chlorophenyl)5(((2E)3phenylprop2en1yl)sulfanyl)4H124triazol3yl)pyridine
3(4(4CHLOROPHENYL)5(((E)3PHENYLPROP2ENYL)THIO)124TRIAZOL3YL)PYRIDINE
3(4(4CHLOROPHENYL)5(((E)CINNAMYL)THIO)124TRIAZOL3YL)PYRIDINE
3(4(4CHLOROPHENYL)5((E)3PHENYLALLYLSULFANYL)4H(124)TRIAZOL3YL)PYRIDINE
3(4(4CHLOROPHENYL)5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOL3YL)PYRIDINE
C1=CC=C(C=C1)C=CCSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CN=CC=C4
Clc1ccc(cc1)n1c(SCC=Cc2ccccc2)nnc1c1cccnc1
InChI=1SC22H17ClN4Sc2319101220(131119)2721(189414241618)252622(27)281558176213717h11416H15H2b85+
MFCD05678814
ZINC000002446507
ZINC02446507
ZINC2446507

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Available files

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