Vitas-M small molecule compound
N-{3-[4-methyl-5-({2-[(3-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]phenyl}benzamide
Catalog ID
STK119509
SMILES O=C(Nc1cccc(c1)C)CSc1nnc(n1C)c1cccc(c1)NC(=O)c1ccccc1
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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/c1-17-8-6-12-20(14-17)26-22(31)16-33-25-29-28-23(30(25)2)19-11-7-13-21(15-19)27-24(32)18-9-4-3-5-10-18/h3-15H,16H2,1-2H3,(H,26,31)(H,27,32)InChIKey
DIQFFHMACLAWHF-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2C)C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4
InChI=1SC25H23N5O2Sc117861220(1417)2622(31)163325292823(30(25)2)191171321(1519)2724(32)1894351018h315H16H212H3(H2631)(H2732)
MFCD03700345
N(3(4METHYL5((2((3METHYLPHENYL)AMINO)2OXOETHYL)SULFANYL)4H124TRIAZOL3YL)PHENYL)BENZAMIDE
N(3(4METHYL5(2(3METHYLANILINO)2OXOETHYL)SULFANYL124TRIAZOL3YL)PHENYL)BENZAMIDE
ZINC000009805596
ZINC09805596
ZINC9805596
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