Vitas-M small molecule compound

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

Catalog ID
STL053594
SMILES Clc1cccc(c1)CSc1nnc(n1C)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 C14H12ClN5S MW 317.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12ClN5S/c1-20-13(12-8-16-5-6-17-12)18-19-14(20)21-9-10-3-2-4-11(15)7-10/h2-8H,9H2,1H3
InChIKey
IJDPPQJVDAKDRK-UHFFFAOYSA-N
Synonyms
585559-72-4
2(5(((3CHLOROPHENYL)METHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)PYRAZINE
2(5((3CHLOROBENZYL)SULFANYL)4METHYL4H124TRIAZOL3YL)PYRAZINE
2(5((3chlorobenzyl)thio)4methyl4H124triazol3yl)pyrazine
2(5((3CHLOROPHENYL)METHYLSULFANYL)4METHYL124TRIAZOL3YL)PYRAZINE
3((3CHLOROPHENYL)METHYLTHIO)4METHYL5PYRAZIN2YL124TRIAZOLE
585559724
CN1C(=NN=C1SCC2=CC(=CC=C2)Cl)C3=NC=CN=C3
InChI=1SC14H12ClN5Sc12013(12816561712)181914(20)2191032411(15)710h28H9H21H3
MFCD04030632
ZINC000000532612
ZINC00532612
ZINC532612

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Available files

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