Vitas-M small molecule compound

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

Catalog ID
STK957656
SMILES C=CCn1c(SCC(=O)c2ccccc2)nnc1CNc1ccccc1

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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 C20H20N4OS MW 364.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4OS/c1-2-13-24-19(14-21-17-11-7-4-8-12-17)22-23-20(24)26-15-18(25)16-9-5-3-6-10-16/h2-12,21H,1,13-15H2
InChIKey
BQHHCYWTDNBDNX-UHFFFAOYSA-N
Synonyms

1phenyl2((5((phenylamino)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)ethanone
2((5(ANILINOMETHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
C=CCN1C(=NN=C1SCC(=O)C2=CC=CC=C2)CNC3=CC=CC=C3
InChI=1SC20H20N4OSc12132419(142117117481217)222320(24)261518(25)1695361016h21221H11315H2
MFCD01433222
ZINC000002742513
ZINC02742513
ZINC2742513

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Available files

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