Vitas-M small molecule compound

4-[({[5-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzamide

Catalog ID
STL299053
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccc(cc2)C(=O)N)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 C25H22ClN5O3S MW 508.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O3S/c1-2-34-21-13-11-20(12-14-21)31-24(17-3-7-18(26)8-4-17)29-30-25(31)35-15-22(32)28-19-9-5-16(6-10-19)23(27)33/h3-14H,2,15H2,1H3,(H2,27,33)(H,28,32)
InChIKey
LAPYSVLWNRGXRM-UHFFFAOYSA-N
Synonyms
862116-85-6
4((((5(4chlorophenyl)4(4ethoxyphenyl)4H124triazol3yl)sulfanyl)acetyl)amino)benzamide
4((2((5(4CHLOROPHENYL)4(4ETHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZAMIDE
4(2((5(4CHLOROPHENYL)4(4ETHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)BENZAMIDE
4(2((5(4chlorophenyl)4(4ethoxyphenyl)4H124triazol3yl)thio)acetamido)benzamide
4(2(5(4CHLOROPHENYL)4(4ETHOXYPHENYL)124TRIAZOL3YLTHIO)ACETYLAMINO)BENZAMIDE
862116856
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)C(=O)N)C4=CC=C(C=C4)Cl
InChI=1SC25H22ClN5O3Sc123421131120(121421)3124(173718(26)8417)293025(31)351522(32)28199516(61019)23(27)33h314H215H21H3(H22733)(H2832)
MFCD05687114
ZINC000009309406
ZINC09309406
ZINC9309406

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Available files

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