Vitas-M small molecule compound

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

Catalog ID
STL299047
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2c2ccccc2)nnc1c1ccc(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 C29H23ClN4O2S MW 527.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23ClN4O2S/c1-36-24-17-15-23(16-18-24)34-28(21-11-13-22(30)14-12-21)32-33-29(34)37-19-27(35)31-26-10-6-5-9-25(26)20-7-3-2-4-8-20/h2-18H,19H2,1H3,(H,31,35)
InChIKey
RDZNDXBOWVXXAL-UHFFFAOYSA-N
Synonyms
861649-80-1
2((5(4CHLOROPHENYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(2PHENYLPHENYL)ACETAMIDE
2((5(4CHLOROPHENYL)4(4METHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)N(2PHENYLPHENYL)ACETAMIDE
2(5(4CHLOROPHENYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))N(2PHENYLPHENYL)ACETAMIDE
861649801
COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=CC=C3C4=CC=CC=C4)C5=CC=C(C=C5)Cl
InChI=1SC29H23ClN4O2Sc13624171523(161824)3428(21111322(30)141221)323329(34)371927(35)31261065925(26)207324820h218H19H21H3(H3135)
MFCD05528852
N((11biphenyl)2yl)2((5(4chlorophenyl)4(4methoxyphenyl)4H124triazol3yl)thio)acetamide
N(biphenyl2yl)2((5(4chlorophenyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)acetamide
ZINC000097958276
ZINC97958276

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.