Vitas-M small molecule compound

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

Catalog ID
STK575730
SMILES O=C(Nc1ccc(cc1)C(=O)N)CSc1nnc(n1c1ccc(cc1)C)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 C25H23N5O2S MW 457.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O2S/c1-16-6-12-21(13-7-16)30-24(19-5-3-4-17(2)14-19)28-29-25(30)33-15-22(31)27-20-10-8-18(9-11-20)23(26)32/h3-14H,15H2,1-2H3,(H2,26,32)(H,27,31)
InChIKey
NBUFPXIWERTYGF-UHFFFAOYSA-N
Synonyms
849007-87-0
4((((5(3methylphenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)acetyl)amino)benzamide
4((2((5(3METHYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZAMIDE
4(2((5(3METHYLPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)BENZAMIDE
4(2((5(mtolyl)4(ptolyl)4H124triazol3yl)thio)acetamido)benzamide
4(2(4(4METHYLPHENYL)5(3METHYLPHENYL)124TRIAZOL3YLTHIO)ACETYLAMINO)BENZAMIDE
849007870
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)C(=O)N)C4=CC(=CC=C4)C
InChI=1SC25H23N5O2Sc11661221(13716)3024(1953417(2)1419)282925(30)331522(31)272010818(91120)23(26)32h314H15H212H3(H22632)(H2731)
MFCD05518276
ZINC000002450884
ZINC02450884
ZINC2450884

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Available files

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