Vitas-M small molecule compound

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

Catalog ID
STK585836
SMILES C=CCn1c(SCc2ccc(cc2)C#N)nnc1c1ccccc1

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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 C19H16N4S MW 332.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N4S/c1-2-12-23-18(17-6-4-3-5-7-17)21-22-19(23)24-14-16-10-8-15(13-20)9-11-16/h2-11H,1,12,14H2
InChIKey
BZECSDGWDJOEPN-UHFFFAOYSA-N
Synonyms
801237-12-7
4(((4allyl5phenyl4H124triazol3yl)thio)methyl)benzonitrile
4(((5phenyl4(prop2en1yl)4H124triazol3yl)sulfanyl)methyl)benzonitrile
4((5PHENYL4PROP2ENYL124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
4(4ALLYL5PHENYL4H(124)TRIAZOL3YLSULFANYLMETHYL)BENZONITRILE
C=CCN1C(=NN=C1SCC2=CC=C(C=C2)C#N)C3=CC=CC=C3
Registry IDs
MFCD05684229
ZINC000006761238
ZINC06761238
ZINC6761238

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Available files

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