Vitas-M small molecule compound

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

Catalog ID
STK591774
SMILES COc1ccccc1c1nnc(n1c1ccccc1)SCc1ccc(cc1)C#N

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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 C23H18N4OS MW 398.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18N4OS/c1-28-21-10-6-5-9-20(21)22-25-26-23(27(22)19-7-3-2-4-8-19)29-16-18-13-11-17(15-24)12-14-18/h2-14H,16H2,1H3
InChIKey
QUGQQGJLNUUCAY-UHFFFAOYSA-N
Synonyms
801250-01-1
4(((5(2methoxyphenyl)4phenyl4H124triazol3yl)sulfanyl)methyl)benzonitrile
4(((5(2methoxyphenyl)4phenyl4H124triazol3yl)thio)methyl)benzonitrile
4((5(2METHOXYPHENYL)4PHENYL124TRIAZOL3YL)SULFANYLMETHYL)BENZONITRILE
4((5(2METHOXYPHENYL)4PHENYL124TRIAZOL3YLTHIO)METHYL)BENZENECARBONITRILE
801250011
COC1=CC=CC=C1C2=NN=C(N2C3=CC=CC=C3)SCC4=CC=C(C=C4)C#N
InChI=1SC23H18N4OSc128211065920(21)22252623(27(22)197324819)291618131117(1524)121418h214H16H21H3
MFCD06392212
ZINC000002348593
ZINC02348593
ZINC2348593

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Available files

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