Vitas-M small molecule compound
2-{[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Catalog ID
STK098455
SMILES O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccc(cc1)C)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 C25H21ClN4O3S MW 492.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN4O3S/c1-16-2-9-20(10-3-16)30-24(17-4-6-18(26)7-5-17)28-29-25(30)34-15-23(31)27-19-8-11-21-22(14-19)33-13-12-32-21/h2-11,14H,12-13,15H2,1H3,(H,27,31)InChIKey
WKGWSDUJKVTJHY-UHFFFAOYSA-NSynonyms
477331-34-32((5(4CHLOROPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(23DIHYDRO14BENZODIOXIN6YL)ACETAMIDE
2((5(4CHLOROPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N(23DIHYDRO14BENZODIOXIN6YL)ACETAMIDE
2((5(4CHLOROPHENYL)4(PTOLYL)4H124TRIAZOL3YL)THIO)N(23DIHYDROBENZO(B)(14)DIOXIN6YL)ACETAMIDE
477331343
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC4=C(C=C3)OCCO4)C5=CC=C(C=C5)Cl
InChI=1SC25H21ClN4O3Sc1162920(10316)3024(174618(26)7517)282925(30)341523(31)27198112122(1419)3313123221h21114H121315H21H3(H2731)
MFCD03223599
N(2H3HBENZO(34E)14DIOXIN6YL)2(5(4CHLOROPHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl
STK098455
ZINC000001307490
ZINC01307490
ZINC1307490
Check stock
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Check stock on Vitas-MAvailable files
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