Vitas-M small molecule compound

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

Catalog ID
STK807025
SMILES Clc1ccc(cc1)C(=O)CSc1nnc(n1c1ccccc1)CCc1nnc(n1c1ccccc1)SCC(=O)c1ccc(cc1)Cl

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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 C34H26Cl2N6O2S2 MW 685.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H26Cl2N6O2S2/c35-25-15-11-23(12-16-25)29(43)21-45-33-39-37-31(41(33)27-7-3-1-4-8-27)19-20-32-38-40-34(42(32)28-9-5-2-6-10-28)46-22-30(44)24-13-17-26(36)18-14-24/h1-18H,19-22H2
InChIKey
IQWCXVCUZHPVFU-UHFFFAOYSA-N
Synonyms
500267-71-0
1(4CHLOROPHENYL)2((5(2(5(2(4CHLOROPHENYL)2OXOETHYL)SULFANYL4PHENYL124TRIAZOL3YL)ETHYL)4PHENYL124TRIAZOL3YL)SULFANYL)ETHANONE
1(4CHLOROPHENYL)2(5(2(5(2(4CHLOROPHENYL)2OXOETHYLTHIO)4PHENYL(124TRIAZOL3YL))ETHYL)4PHENYL(124TRIAZOL3YLTHIO))ETHAN1ONE
22((55(ETHANE12DIYL)BIS(4PHENYL4H124TRIAZOLE53DIYL))BIS(SULFANEDIYL))BIS(1(4CHLOROPHENYL)ETHANONE)
22(ethane12diylbis((4phenyl4H124triazole53diyl)sulfanediyl))bis(1(4chlorophenyl)ethanone)
500267710
C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)C3=CC=C(C=C3)Cl)CCC4=NN=C(N4C5=CC=CC=C5)SCC(=O)C6=CC=C(C=C6)Cl
InChI=1SC34H26Cl2N6O2S2c3525151123(121625)29(43)214533393731(41(33)277314827)192032384034(42(32)2895261028)462230(44)24131726(36)181424h118H1922H2
MFCD03621128
ZINC000097986478
ZINC97986478

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Available files

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