Vitas-M small molecule compound

2-{5-[(3-methylbenzyl)sulfanyl]-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl}pyrazine

Catalog ID
STL042980
SMILES Cc1ccc(cc1)n1c(SCc2cccc(c2)C)nnc1c1nccnc1

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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 C21H19N5S MW 373.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N5S/c1-15-6-8-18(9-7-15)26-20(19-13-22-10-11-23-19)24-25-21(26)27-14-17-5-3-4-16(2)12-17/h3-13H,14H2,1-2H3
InChIKey
NIKPLZYXVPXDNR-UHFFFAOYSA-N
Synonyms
899415-34-0
2(4(4METHYLPHENYL)5(((3METHYLPHENYL)METHYL)SULFANYL)4H124TRIAZOL3YL)PYRAZINE
2(4(4METHYLPHENYL)5((3METHYLPHENYL)METHYLSULFANYL)124TRIAZOL3YL)PYRAZINE
2(5((3METHYLBENZYL)SULFANYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)PYRAZINE
2(5((3methylbenzyl)thio)4(ptolyl)4H124triazol3yl)pyrazine
4(4METHYLPHENYL)3((3METHYLPHENYL)METHYLTHIO)5PYRAZIN2YL124TRIAZOLE
899415340
CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC(=C3)C)C4=NC=CN=C4
InChI=1SC21H19N5Sc1156818(9715)2620(19132210112319)242521(26)27141753416(2)1217h313H14H212H3
MFCD06607199
ZINC000002331867
ZINC02331867
ZINC2331867

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Available files

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