Vitas-M small molecule compound

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

Catalog ID
STK804167
SMILES COc1ccc(cc1)C(=O)CSc1nnc(n1c1ccccc1)c1cccs1

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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 C21H17N3O2S2 MW 407.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O2S2/c1-26-17-11-9-15(10-12-17)18(25)14-28-21-23-22-20(19-8-5-13-27-19)24(21)16-6-3-2-4-7-16/h2-13H,14H2,1H3
InChIKey
ZZJQDQMIHNEMLH-UHFFFAOYSA-N
Synonyms
326881-98-5
1(4METHOXYPHENYL)2((4PHENYL5(2THIENYL)4H124TRIAZOL3YL)THIO)ETHANONE
1(4methoxyphenyl)2((4phenyl5(thiophen2yl)4H124triazol3yl)sulfanyl)ethanone
1(4METHOXYPHENYL)2((4PHENYL5(THIOPHEN2YL)4H124TRIAZOL3YL)THIO)ETHANONE
1(4METHOXYPHENYL)2((4PHENYL5THIOPHEN2YL124TRIAZOL3YL)SULFANYL)ETHANONE
1(4METHOXYPHENYL)2(4PHENYL5(2THIENYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
326881985
COC1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CS4
InChI=1SC21H17N3O2S2c1261711915(101217)18(25)142821232220(1985132719)24(21)166324716h213H14H21H3
MFCD02658226
ZINC000001170450
ZINC01170450
ZINC1170450

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Available files

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