Vitas-M small molecule compound

N-(1,3-benzodioxol-5-yl)-2-{[4-(4-chlorophenyl)-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STL051881
SMILES COc1cccc(c1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc2c(c1)OCO2

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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 C24H19ClN4O4S MW 494.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN4O4S/c1-31-19-4-2-3-15(11-19)23-27-28-24(29(23)18-8-5-16(25)6-9-18)34-13-22(30)26-17-7-10-20-21(12-17)33-14-32-20/h2-12H,13-14H2,1H3,(H,26,30)
InChIKey
JAGOFNSRSLHACM-UHFFFAOYSA-N
Synonyms
849824-78-8
849824788
COC1=CC=CC(=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC5=C(C=C4)OCO5
InChI=1SC24H19ClN4O4Sc1311942315(1119)23272824(29(23)188516(25)6918)341322(30)26177102021(1217)33143220h212H1314H21H3(H2630)
MFCD05534907
N(13BENZODIOXOL5YL)2((4(4CHLOROPHENYL)5(3METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13benzodioxol5yl)2((4(4chlorophenyl)5(3methoxyphenyl)4H124triazol3yl)sulfanyl)acetamide
N(2H13BENZODIOXOL5YL)2((4(4CHLOROPHENYL)5(3METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2HBENZO(34D)13DIOXOLEN5YL)2(4(4CHLOROPHENYL)5(3METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(benzo(d)(13)dioxol5yl)2((4(4chlorophenyl)5(3methoxyphenyl)4H124triazol3yl)thio)acetamide
ZINC000009309524
ZINC09309524
ZINC9309524

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Available files

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