Vitas-M small molecule compound
2-{[5-(3-chloro-1-benzothiophen-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
Catalog ID
STK541712
SMILES C=CCn1c(SCC(=O)c2ccccc2)nnc1c1sc2c(c1Cl)cccc2
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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 C21H16ClN3OS2 MW 425.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3OS2/c1-2-12-25-20(19-18(22)15-10-6-7-11-17(15)28-19)23-24-21(25)27-13-16(26)14-8-4-3-5-9-14/h2-11H,1,12-13H2InChIKey
QSSDXYKFFJCJEN-UHFFFAOYSA-NSynonyms
488723-04-22((4allyl5(3chlorobenzo(b)thiophen2yl)4H124triazol3yl)thio)1phenylethanone
2((5(3chloro1benzothiophen2yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)1phenylethanone
2((5(3CHLORO1BENZOTHIOPHEN2YL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2(5(3CHLOROBENZO(B)THIOPHEN2YL)4PROP2ENYL(124TRIAZOL3YLTHIO))1PHENYLETHAN1ONE
488723042
C=CCN1C(=NN=C1SCC(=O)C2=CC=CC=C2)C3=C(C4=CC=CC=C4S3)Cl
InChI=1SC21H16ClN3OS2c12122520(1918(22)1510671117(15)2819)232421(25)271316(26)148435914h211H11213H2
MFCD03268995
ZINC000000727909
ZINC00727909
ZINC727909
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