Vitas-M small molecule compound

1-(4-methoxyphenyl)-2-{[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Catalog ID
STL042969
SMILES COc1ccc(cc1)C(=O)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1

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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 C22H19N5O2S MW 417.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N5O2S/c1-15-3-7-17(8-4-15)27-21(19-13-23-11-12-24-19)25-26-22(27)30-14-20(28)16-5-9-18(29-2)10-6-16/h3-13H,14H2,1-2H3
InChIKey
CVKHVUVNLYMSPV-UHFFFAOYSA-N
Synonyms
896846-25-6
1(4METHOXYPHENYL)2((4(4METHYLPHENYL)5(PYRAZIN2YL)4H124TRIAZOL3YL)SULFANYL)ETHAN1ONE
1(4METHOXYPHENYL)2((4(4METHYLPHENYL)5(PYRAZIN2YL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
1(4METHOXYPHENYL)2((4(4METHYLPHENYL)5PYRAZIN2YL124TRIAZOL3YL)SULFANYL)ETHANONE
1(4methoxyphenyl)2((5(pyrazin2yl)4(ptolyl)4H124triazol3yl)thio)ethanone
1(4METHOXYPHENYL)2(4(4METHYLPHENYL)5PYRAZIN2YL(124TRIAZOL3YLTHIO))ETHAN1ONE
896846256
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=C(C=C3)OC)C4=NC=CN=C4
InChI=1SC22H19N5O2Sc1153717(8415)2721(19132311122419)252622(27)301420(28)165918(292)10616h313H14H212H3
MFCD06601986
ZINC000002230547
ZINC02230547
ZINC2230547

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Available files

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