Vitas-M small molecule compound

3-(3-chlorophenyl)-4-(furan-2-ylmethyl)-5-[(4-methoxybenzyl)sulfanyl]-4H-1,2,4-triazole

Catalog ID
STK586025
SMILES COc1ccc(cc1)CSc1nnc(n1Cc1ccco1)c1cccc(c1)Cl

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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 C21H18ClN3O2S MW 411.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O2S/c1-26-18-9-7-15(8-10-18)14-28-21-24-23-20(16-4-2-5-17(22)12-16)25(21)13-19-6-3-11-27-19/h2-12H,13-14H2,1H3
InChIKey
MXLNWTSMCJYCFW-UHFFFAOYSA-N
Synonyms
896593-13-8
1((5(3CHLOROPHENYL)4(2FURYLMETHYL)(124TRIAZOL3YLTHIO))METHYL)4METHOXYBENZENE
3(3CHLOROPHENYL)4(FURAN2YLMETHYL)5(((4METHOXYPHENYL)METHYL)SULFANYL)4H124TRIAZOLE
3(3chlorophenyl)4(furan2ylmethyl)5((4methoxybenzyl)sulfanyl)4H124triazole
3(3chlorophenyl)4(furan2ylmethyl)5((4methoxybenzyl)thio)4H124triazole
3(3CHLOROPHENYL)4(FURAN2YLMETHYL)5((4METHOXYPHENYL)METHYLSULFANYL)124TRIAZOLE
896593138
COC1=CC=C(C=C1)CSC2=NN=C(N2CC3=CC=CO3)C4=CC(=CC=C4)Cl
InChI=1SC21H18ClN3O2Sc126189715(81018)142821242320(1642517(22)1216)25(21)131963112719h212H1314H21H3
MFCD06594404
ZINC000002443044
ZINC02443044
ZINC2443044

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Available files

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