Vitas-M small molecule compound
3-(3-chloro-1-benzothiophen-2-yl)-4-(4-chlorophenyl)-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Catalog ID
STK807582
SMILES Clc1ccc(cc1)n1c(SC/C=C/c2ccccc2)nnc1c1sc2c(c1Cl)cccc2
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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 C25H17Cl2N3S2 MW 494.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17Cl2N3S2/c26-18-12-14-19(15-13-18)30-24(23-22(27)20-10-4-5-11-21(20)32-23)28-29-25(30)31-16-6-9-17-7-2-1-3-8-17/h1-15H,16H2/b9-6+InChIKey
MBISBXYVAIRTEK-RMKNXTFCSA-NSynonyms
3(3chloro1benzothiophen2yl)4(4chlorophenyl)5(((2E)3phenylprop2en1yl)sulfanyl)4H124triazole
3(3CHLORO1BENZOTHIOPHEN2YL)4(4CHLOROPHENYL)5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOLE
5((2E)3PHENYLPROP2ENYLTHIO)3(3CHLOROBENZO(B)THIOPHEN2YL)4(4CHLOROPHENYL)124TRIAZOLE
C1=CC=C(C=C1)C=CCSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=C(C5=CC=CC=C5S4)Cl
Clc1ccc(cc1)n1c(SCC=Cc2ccccc2)nnc1c1sc2c(c1Cl)cccc2
InChI=1SC25H17Cl2N3S2c2618121419(151318)3024(2322(27)2010451121(20)3223)282925(30)311669177213817h115H16H2b96+
MFCD05718547
ZINC000015441330
ZINC15441330
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