Vitas-M small molecule compound

1-(3-nitrophenyl)-2-{[4-phenyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone

Catalog ID
STK804131
SMILES O=C(c1cccc(c1)[N+](=O)[O-])CSc1nnc(n1c1ccccc1)c1ccncc1

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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 C21H15N5O3S MW 417.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N5O3S/c27-19(16-5-4-8-18(13-16)26(28)29)14-30-21-24-23-20(15-9-11-22-12-10-15)25(21)17-6-2-1-3-7-17/h1-13H,14H2
InChIKey
LUNCEDMVKGLOHN-UHFFFAOYSA-N
Synonyms
326889-65-0
1(3nitrophenyl)2((4phenyl5(pyridin4yl)4H124triazol3yl)sulfanyl)ethanone
1(3NITROPHENYL)2((4PHENYL5(PYRIDIN4YL)4H124TRIAZOL3YL)THIO)ETHANONE
1(3NITROPHENYL)2((4PHENYL5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ETHANONE
1(3NITROPHENYL)2(4PHENYL5(4PYRIDYL)(124TRIAZOL3YLTHIO))ETHAN1ONE
326889650
C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC(=CC=C3)(N+)(=O)(O))C4=CC=NC=C4
InChI=1SC21H15N5O3Sc2719(1654818(1316)26(28)29)143021242320(1591122121015)25(21)176213717h113H14H2
MFCD02658767
O=C(c1cccc(c1)(N+)(=O)(O))CSc1nnc(n1c1ccccc1)c1ccncc1
ZINC000001184443
ZINC01184443
ZINC1184443

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Available files

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