Vitas-M small molecule compound
5-[({[5-(1,3-benzodioxol-5-yl)-4-(3,5-dichlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-2-chlorobenzoic acid
Catalog ID
STK688497
SMILES O=C(Nc1ccc(c(c1)C(=O)O)Cl)CSc1nnc(n1c1cc(Cl)cc(c1)Cl)c1ccc2c(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 C24H15Cl3N4O5S MW 577.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H15Cl3N4O5S/c25-13-6-14(26)8-16(7-13)31-22(12-1-4-19-20(5-12)36-11-35-19)29-30-24(31)37-10-21(32)28-15-2-3-18(27)17(9-15)23(33)34/h1-9H,10-11H2,(H,28,32)(H,33,34)InChIKey
XTIKCPTVBAYWRS-UHFFFAOYSA-NSynonyms
898128-90-05((((5(13BENZODIOXOL5YL)4(35DICHLOROPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)2CHLOROBENZOICACID
5((2((5(13BENZODIOXOL5YL)4(35DICHLOROPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)2CHLOROBENZOICACID
898128900
C1OC2=C(O1)C=C(C=C2)C3=NN=C(N3C4=CC(=CC(=C4)Cl)Cl)SCC(=O)NC5=CC(=C(C=C5)Cl)C(=O)O
InChI=1SC24H15Cl3N4O5Sc2513614(26)816(713)3122(12141920(512)36113519)293024(31)371021(32)28152318(27)17(915)23(33)34h19H1011H2(H2832)(H3334)
MFCD07657758
ZINC000098008968
ZINC98008968
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