Vitas-M small molecule compound

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

Catalog ID
STK571008
SMILES COc1cccc(c1)CSc1nnc(n1c1ccccc1)c1nccnc1

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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 C20H17N5OS MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N5OS/c1-26-17-9-5-6-15(12-17)14-27-20-24-23-19(18-13-21-10-11-22-18)25(20)16-7-3-2-4-8-16/h2-13H,14H2,1H3
InChIKey
XMPDEDJIHJZDBP-UHFFFAOYSA-N
Synonyms
896856-42-1
2(5(((3METHOXYPHENYL)METHYL)SULFANYL)4PHENYL4H124TRIAZOL3YL)PYRAZINE
2(5((3methoxybenzyl)sulfanyl)4phenyl4H124triazol3yl)pyrazine
2(5((3methoxybenzyl)thio)4phenyl4H124triazol3yl)pyrazine
2(5((3METHOXYPHENYL)METHYLSULFANYL)4PHENYL124TRIAZOL3YL)PYRAZINE
3METHOXY1((4PHENYL5PYRAZIN2YL(124TRIAZOL3YLTHIO))METHYL)BENZENE
896856421
COC1=CC=CC(=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=NC=CN=C4
InChI=1SC20H17N5OSc1261795615(1217)142720242319(18132110112218)25(20)167324816h213H14H21H3
MFCD06603976
ZINC000002241511
ZINC02241511
ZINC2241511

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Available files

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