Vitas-M small molecule compound
N-(3-{[5-(1,3-benzodioxol-5-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}propyl)-4-(methylsulfonyl)-2-nitroaniline
Catalog ID
STK808171
SMILES Cn1c(SCCCNc2ccc(cc2[N+](=O)[O-])S(=O)(=O)C)nnc1c1ccc2c(c1)OCO2
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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 C20H21N5O6S2 MW 491.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O6S2/c1-24-19(13-4-7-17-18(10-13)31-12-30-17)22-23-20(24)32-9-3-8-21-15-6-5-14(33(2,28)29)11-16(15)25(26)27/h4-7,10-11,21H,3,8-9,12H2,1-2H3InChIKey
UCYQVAHNAWDZMZ-UHFFFAOYSA-NSynonyms
912906-84-41((3(5(2HBENZO(34D)13DIOXOLAN5YL)4METHYL(124TRIAZOL3YLTHIO))PROPYL)AMINO)4(METHYLSULFONYL)2NITROBENZENE
912906844
CN1C(=NN=C1SCCCNC2=C(C=C(C=C2)S(=O)(=O)C)(N+)(=O)(O))C3=CC4=C(C=C3)OCO4
Cn1c(SCCCNc2ccc(cc2(N+)(=O)(O))S(=O)(=O)C)nnc1c1ccc2c(c1)OCO2
InChI=1SC20H21N5O6S2c12419(13471718(1013)31123017)222320(24)3293821156514(33(228)29)1116(15)25(26)27h47101121H38912H212H3
MFCD09250109
N(3((5(13benzodioxol5yl)4methyl124triazol3yl)sulfanyl)propyl)4methylsulfonyl2nitroaniline
N(3((5(13benzodioxol5yl)4methyl4H124triazol3yl)sulfanyl)propyl)4(methylsulfonyl)2nitroaniline
N(3((5(BENZO(D)(13)DIOXOL5YL)4METHYL4H124TRIAZOL3YL)THIO)PROPYL)4(METHYLSULFONYL)2NITROANILINE
ZINC000008843949
ZINC08843949
ZINC8843949
Check stock
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Check stock on Vitas-MAvailable files
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