Vitas-M small molecule compound

3-(4-nitrophenyl)-4-phenyl-5-(prop-2-en-1-ylsulfanyl)-4H-1,2,4-triazole

Catalog ID
STK121484
SMILES C=CCSc1nnc(n1c1ccccc1)c1ccc(cc1)[N+](=O)[O-]

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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 C17H14N4O2S MW 338.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4O2S/c1-2-12-24-17-19-18-16(20(17)14-6-4-3-5-7-14)13-8-10-15(11-9-13)21(22)23/h2-11H,1,12H2
InChIKey
KTIUNKIMZIYNQD-UHFFFAOYSA-N
Synonyms
313982-12-6
3(4NITROPHENYL)4PHENYL5(PROP2EN1YLSULFANYL)4H124TRIAZOLE
3(4NITROPHENYL)4PHENYL5PROP2ENYLSULFANYL124TRIAZOLE
3(allylthio)5(4nitrophenyl)4phenyl4H124triazole
313982126
3ALLYLSULFANYL5(4NITROPHENYL)4PHENYL4H(124)TRIAZOLE
5(4NITROPHENYL)4PHENYL3PROP2ENYLTHIO124TRIAZOLE
C=CCSC1=NN=C(N1C2=CC=CC=C2)C3=CC=C(C=C3)(N+)(=O)(O)
C=CCSc1nnc(n1c1ccccc1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC17H14N4O2Sc12122417191816(20(17)146435714)1381015(11913)21(22)23h211H112H2
MFCD01162615
ZINC000002281375
ZINC02281375
ZINC2281375

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Available files

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