Vitas-M small molecule compound

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

Catalog ID
STL299017
SMILES O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1c1ccc(cc1)Cl)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 C23H16Cl2N4O3S MW 499.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16Cl2N4O3S/c24-15-3-1-14(2-4-15)22-27-28-23(29(22)18-8-5-16(25)6-9-18)33-12-21(30)26-17-7-10-19-20(11-17)32-13-31-19/h1-11H,12-13H2,(H,26,30)
InChIKey
DOTPOBRMUNHRHO-UHFFFAOYSA-N
Synonyms
861637-59-4
861637594
C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NN=C(N3C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl
InChI=1SC23H16Cl2N4O3Sc24153114(2415)22272823(29(22)188516(25)6918)331221(30)26177101920(1117)32133119h111H1213H2(H2630)
MFCD05515058
N(13BENZODIOXOL5YL)2((45BIS(4CHLOROPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13benzodioxol5yl)2((45bis(4chlorophenyl)4H124triazol3yl)sulfanyl)acetamide
N(2H13BENZODIOXOL5YL)2((45BIS(4CHLOROPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2HBENZO(34D)13DIOXOLEN5YL)2(45BIS(4CHLOROPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(benzo(d)(13)dioxol5yl)2((45bis(4chlorophenyl)4H124triazol3yl)thio)acetamide
ZINC000009309079
ZINC09309079
ZINC9309079

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Available files

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