Vitas-M small molecule compound
4-(methylsulfonyl)-2-nitro-N-(3-{[5-(thiophen-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl}propyl)aniline
Catalog ID
STK808173
SMILES [O-][N+](=O)c1cc(ccc1NCCCSc1nnc(o1)c1cccs1)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 C16H16N4O5S3 MW 440.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O5S3/c1-28(23,24)11-5-6-12(13(10-11)20(21)22)17-7-3-9-27-16-19-18-15(25-16)14-4-2-8-26-14/h2,4-6,8,10,17H,3,7,9H2,1H3InChIKey
LUUXQKPBUYKATP-UHFFFAOYSA-NSynonyms
912906-88-8(O)(N+)(=O)c1cc(ccc1NCCCSc1nnc(o1)c1cccs1)S(=O)(=O)C
4(METHYLSULFONYL)2NITRO1((3(5(2THIENYL)(134OXADIAZOL2YLTHIO))PROPYL)AMINO)BENZENE
4(methylsulfonyl)2nitroN(3((5(thiophen2yl)134oxadiazol2yl)sulfanyl)propyl)aniline
4(METHYLSULFONYL)2NITRON(3((5(THIOPHEN2YL)134OXADIAZOL2YL)THIO)PROPYL)ANILINE
4methylsulfonyl2nitroN(3((5thiophen2yl134oxadiazol2yl)sulfanyl)propyl)aniline
912906888
CS(=O)(=O)C1=CC(=C(C=C1)NCCCSC2=NN=C(O2)C3=CC=CS3)(N+)(=O)(O)
InChI=1SC16H16N4O5S3c128(2324)115612(13(1011)20(21)22)177392716191815(2516)144282614h24681017H379H21H3
MFCD09250111
ZINC000008843950
ZINC08843950
ZINC8843950
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