Vitas-M small molecule compound

2-({5-[(2-methoxyphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-1-phenylethanone

Catalog ID
STK230265
SMILES C=CCn1c(SCC(=O)c2ccccc2)nnc1COc1ccccc1OC

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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 C21H21N3O3S MW 395.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3S/c1-3-13-24-20(14-27-19-12-8-7-11-18(19)26-2)22-23-21(24)28-15-17(25)16-9-5-4-6-10-16/h3-12H,1,13-15H2,2H3
InChIKey
ZOHDCCQUUMINSC-UHFFFAOYSA-N
Synonyms

2((5((2METHOXYPHENOXY)METHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((5((2METHOXYPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
COC1=CC=CC=C1OCC2=NN=C(N2CC=C)SCC(=O)C3=CC=CC=C3
InChI=1SC21H21N3O3Sc13132420(14271912871118(19)262)222321(24)281517(25)1695461016h312H11315H22H3
MFCD07395056
ZINC000004735902
ZINC04735902
ZINC4735902

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Available files

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