Vitas-M small molecule compound
2-{[4-(4-chlorophenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Catalog ID
STK569890
SMILES O=C(Nc1ccc2c(c1)OCCO2)CSc1nnc(n1c1ccc(cc1)Cl)c1cccc(c1)C
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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/c1-16-3-2-4-17(13-16)24-28-29-25(30(24)20-8-5-18(26)6-9-20)34-15-23(31)27-19-7-10-21-22(14-19)33-12-11-32-21/h2-10,13-14H,11-12,15H2,1H3,(H,27,31)InChIKey
QXMFGGBSHTURSH-UHFFFAOYSA-NSynonyms
861138-49-02((4(4CHLOROPHENYL)5(3METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(23DIHYDRO14BENZODIOXIN6YL)ACETAMIDE
2((4(4chlorophenyl)5(3methylphenyl)4H124triazol3yl)sulfanyl)N(23dihydro14benzodioxin6yl)acetamide
2((4(4chlorophenyl)5(mtolyl)4H124triazol3yl)thio)N(23dihydrobenzo(b)(14)dioxin6yl)acetamide
861138490
CC1=CC=CC(=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC5=C(C=C4)OCCO5
InChI=1SC25H21ClN4O3Sc11632417(1316)24282925(30(24)208518(26)6920)341523(31)27197102122(1419)3312113221h2101314H111215H21H3(H2731)
MFCD05683663
N(2H3HBENZO(34E)14DIOXIN6YL)2(4(4CHLOROPHENYL)5(3METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000009307891
ZINC09307891
ZINC9307891
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