Vitas-M small molecule compound
N-[4-(benzyloxy)phenyl]-2-{[4-(4-methylphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK572975
SMILES O=C(Nc1ccc(cc1)OCc1ccccc1)CSc1nnc(n1c1ccc(cc1)C)COc1ccccc1
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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 C31H28N4O3S MW 536.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N4O3S/c1-23-12-16-26(17-13-23)35-29(21-38-27-10-6-3-7-11-27)33-34-31(35)39-22-30(36)32-25-14-18-28(19-15-25)37-20-24-8-4-2-5-9-24/h2-19H,20-22H2,1H3,(H,32,36)InChIKey
BIXQWTXWIGCGJO-UHFFFAOYSA-NSynonyms
333328-51-12((4(4METHYLPHENYL)5(PHENOXYMETHYL)124TRIAZOL3YL)SULFANYL)N(4PHENYLMETHOXYPHENYL)ACETAMIDE
2(4(4METHYLPHENYL)5(PHENOXYMETHYL)(124TRIAZOL3YLTHIO))N(4(PHENYLMETHOXY)PHENYL)ACETAMIDE
333328511
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=C(C=C3)OCC4=CC=CC=C4)COC5=CC=CC=C5
InChI=1SC31H28N4O3Sc123121626(171323)3529(213827106371127)333431(35)392230(36)3225141828(191525)3720248425924h219H2022H21H3(H3236)
MFCD02740530
N(4(benzyloxy)phenyl)2((4(4methylphenyl)5(phenoxymethyl)4H124triazol3yl)sulfanyl)acetamide
N(4(benzyloxy)phenyl)2((5(phenoxymethyl)4(ptolyl)4H124triazol3yl)thio)acetamide
ZINC000002074306
ZINC02074306
ZINC2074306
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