Vitas-M small molecule compound
N-{[4-ethyl-5-({2-[(5-methyl-4-phenyl-1,3-thiazol-2-yl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}-3-nitrobenzamide
Catalog ID
STL428733
SMILES CCn1c(SCC(=O)Nc2sc(c(n2)c2ccccc2)C)nnc1CNC(=O)c1cccc(c1)[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 C24H23N7O4S2 MW 537.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N7O4S2/c1-3-30-19(13-25-22(33)17-10-7-11-18(12-17)31(34)35)28-29-24(30)36-14-20(32)26-23-27-21(15(2)37-23)16-8-5-4-6-9-16/h4-12H,3,13-14H2,1-2H3,(H,25,33)(H,26,27,32)InChIKey
WLLLWWNQOCDCRY-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)NC2=NC(=C(S2)C)C3=CC=CC=C3)CNC(=O)C4=CC(=CC=C4)(N+)(=O)(O)
CCn1c(SCC(=O)Nc2sc(c(n2)c2ccccc2)C)nnc1CNC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC24H23N7O4S2c133019(132522(33)171071118(1217)31(34)35)282924(30)361420(32)26232721(15(2)3723)168546916h412H31314H212H3(H2533)(H262732)
MFCD03996694
N((4ethyl5((2((5methyl4phenyl13thiazol2yl)amino)2oxoethyl)sulfanyl)4H124triazol3yl)methyl)3nitrobenzamide
N((4ETHYL5(2((5METHYL4PHENYL13THIAZOL2YL)AMINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)METHYL)3NITROBENZAMIDE
ZINC000002837698
ZINC2837698
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