Vitas-M small molecule compound
2,2'-{butane-1,4-diylbis[(4-phenyl-4H-1,2,4-triazole-5,3-diyl)sulfanediyl]}bis(1-phenylethanone)
Catalog ID
STK807059
SMILES O=C(c1ccccc1)CSc1nnc(n1c1ccccc1)CCCCc1nnc(n1c1ccccc1)SCC(=O)c1ccccc1
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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 C36H32N6O2S2 MW 644.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H32N6O2S2/c43-31(27-15-5-1-6-16-27)25-45-35-39-37-33(41(35)29-19-9-3-10-20-29)23-13-14-24-34-38-40-36(42(34)30-21-11-4-12-22-30)46-26-32(44)28-17-7-2-8-18-28/h1-12,15-22H,13-14,23-26H2InChIKey
AYAHRMVMVVKGGY-UHFFFAOYSA-NSynonyms
496775-73-62((5(4(5PHENACYLSULFANYL4PHENYL124TRIAZOL3YL)BUTYL)4PHENYL124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2(5(4(5(2OXO2PHENYLETHYLTHIO)4PHENYL(124TRIAZOL3YL))BUTYL)4PHENYL(124TRIAZOL3YLTHIO))1PHENYLETHAN1ONE
22((55(BUTANE14DIYL)BIS(4PHENYL4H124TRIAZOLE53DIYL))BIS(SULFANEDIYL))BIS(1PHENYLETHANONE)
22(butane14diylbis((4phenyl4H124triazole53diyl)sulfanediyl))bis(1phenylethanone)
496775736
C1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)CCCCC4=NN=C(N4C5=CC=CC=C5)SCC(=O)C6=CC=CC=C6
InChI=1SC36H32N6O2S2c4331(27155161627)254535393733(41(35)291993102029)2313142434384036(42(34)3021114122230)462632(44)28177281828h1121522H13142326H2
MFCD03621186
ZINC000097986512
ZINC97986512
Check stock
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Check stock on Vitas-MAvailable files
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