Vitas-M small molecule compound

4-({[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile

Catalog ID
STL348300
SMILES N#Cc1ccc(cc1)CSc1nnc(n1c1ccccc1)c1ccccc1Cl

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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 C22H15ClN4S MW 402.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClN4S/c23-20-9-5-4-8-19(20)21-25-26-22(27(21)18-6-2-1-3-7-18)28-15-17-12-10-16(14-24)11-13-17/h1-13H,15H2
InChIKey
ZBTBMHRHGHXBSV-UHFFFAOYSA-N
Synonyms
710982-48-2
4(((5(2chlorophenyl)4phenyl4H124triazol3yl)sulfanyl)methyl)benzonitrile
4(((5(2chlorophenyl)4phenyl4H124triazol3yl)thio)methyl)benzonitrile
4((5(2CHLOROPHENYL)4PHENYL124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
710982482
C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)C#N)C4=CC=CC=C4Cl
InChI=1SC22H15ClN4Sc2320954819(20)21252622(27(21)186213718)281517121016(1424)111317h113H15H2
MFCD05686990
ZINC000002865528
ZINC02865528
ZINC2865528

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Available files

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