Vitas-M small molecule compound

3-[(4-nitrobenzyl)sulfanyl]-4-(prop-2-en-1-yl)-5-(thiophen-2-yl)-4H-1,2,4-triazole

Catalog ID
STK804159
SMILES C=CCn1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1cccs1

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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 C16H14N4O2S2 MW 358.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O2S2/c1-2-9-19-15(14-4-3-10-23-14)17-18-16(19)24-11-12-5-7-13(8-6-12)20(21)22/h2-8,10H,1,9,11H2
InChIKey
ZMLNAYADEGHVEF-UHFFFAOYSA-N
Synonyms
488746-46-9
3((4nitrobenzyl)sulfanyl)4(prop2en1yl)5(thiophen2yl)4H124triazole
3((4nitrophenyl)methylsulfanyl)4prop2enyl5thiophen2yl124triazole
3((4NITROPHENYL)METHYLTHIO)4PROP2ENYL5(2THIENYL)124TRIAZOLE
488746469
4allyl3((4nitrobenzyl)thio)5(thiophen2yl)4H124triazole
C=CCN1C(=NN=C1SCC2=CC=C(C=C2)(N+)(=O)(O))C3=CC=CS3
C=CCn1c(SCc2ccc(cc2)(N+)(=O)(O))nnc1c1cccs1
InChI=1SC16H14N4O2S2c1291915(1443102314)171816(19)2411125713(8612)20(21)22h2810H1911H2
MFCD03292385
ZINC000000957032
ZINC00957032
ZINC957032

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Available files

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