Vitas-M small molecule compound

2,2'-{ethane-1,2-diylbis[(4-phenyl-4H-1,2,4-triazole-5,3-diyl)sulfanediyl]}bis(1-phenylethanone)

Catalog ID
STK807020
SMILES O=C(c1ccccc1)CSc1nnc(n1c1ccccc1)CCc1nnc(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 C34H28N6O2S2 MW 616.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H28N6O2S2/c41-29(25-13-5-1-6-14-25)23-43-33-37-35-31(39(33)27-17-9-3-10-18-27)21-22-32-36-38-34(40(32)28-19-11-4-12-20-28)44-24-30(42)26-15-7-2-8-16-26/h1-20H,21-24H2
InChIKey
INNXXDOPJKXCFF-UHFFFAOYSA-N
Synonyms
500267-67-4
2((5(2(5PHENACYLSULFANYL4PHENYL124TRIAZOL3YL)ETHYL)4PHENYL124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2(5(2(5(2OXO2PHENYLETHYLTHIO)4PHENYL(124TRIAZOL3YL))ETHYL)4PHENYL(124TRIAZOL3YLTHIO))1PHENYLETHAN1ONE
22((55(ETHANE12DIYL)BIS(4PHENYL4H124TRIAZOLE53DIYL))BIS(SULFANEDIYL))BIS(1PHENYLETHANONE)
22(ethane12diylbis((4phenyl4H124triazole53diyl)sulfanediyl))bis(1phenylethanone)
500267674
C1=CC=C(C=C1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)CCC4=NN=C(N4C5=CC=CC=C5)SCC(=O)C6=CC=CC=C6
InChI=1SC34H28N6O2S2c4129(25135161425)234333373531(39(33)271793101827)212232363834(40(32)2819114122028)442430(42)26157281626h120H2124H2
MFCD03621132
ZINC000097986476
ZINC97986476

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Available files

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