Vitas-M small molecule compound

2-[4-(methylsulfonyl)phenyl]-5-[(4-nitrobenzyl)sulfanyl]-1,3,4-oxadiazole

Catalog ID
STK808150
SMILES [O-][N+](=O)c1ccc(cc1)CSc1nnc(o1)c1ccc(cc1)S(=O)(=O)C

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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 C16H13N3O5S2 MW 391.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13N3O5S2/c1-26(22,23)14-8-4-12(5-9-14)15-17-18-16(24-15)25-10-11-2-6-13(7-3-11)19(20)21/h2-9H,10H2,1H3
InChIKey
RPXZUHJYVLUVHF-UHFFFAOYSA-N
Synonyms
923157-70-4
(O)(N+)(=O)c1ccc(cc1)CSc1nnc(o1)c1ccc(cc1)S(=O)(=O)C
1(METHYLSULFONYL)4(5((4NITROPHENYL)METHYLTHIO)(134OXADIAZOL2YL))BENZENE
2(4(methylsulfonyl)phenyl)5((4nitrobenzyl)sulfanyl)134oxadiazole
2(4(METHYLSULFONYL)PHENYL)5((4NITROBENZYL)THIO)134OXADIAZOLE
2(4methylsulfonylphenyl)5((4nitrophenyl)methylsulfanyl)134oxadiazole
923157704
CS(=O)(=O)C1=CC=C(C=C1)C2=NN=C(O2)SCC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC16H13N3O5S2c126(2223)148412(5914)15171816(2415)2510112613(7311)19(20)21h29H10H21H3
MFCD08543316
ZINC000009764102
ZINC09764102
ZINC9764102

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Available files

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