Vitas-M small molecule compound
6-({[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-phenyl-1,3,5-triazine-2,4-diamine
Catalog ID
STK734309
SMILES Nc1nc(CSc2nnc(n2c2ccccc2)c2ccc(cc2)C(C)(C)C)nc(n1)Nc1ccccc1
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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 C28H28N8S MW 508.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N8S/c1-28(2,3)20-16-14-19(15-17-20)24-34-35-27(36(24)22-12-8-5-9-13-22)37-18-23-31-25(29)33-26(32-23)30-21-10-6-4-7-11-21/h4-17H,18H2,1-3H3,(H3,29,30,31,32,33)InChIKey
NMRVPHQNMMFQJU-UHFFFAOYSA-NSynonyms
(4AMINO6((5(4(TERTBUTYL)PHENYL)4PHENYL(124TRIAZOL3YLTHIO))METHYL)(135TRIAZIN2YL))PHENYLAMINE
6(((5(4TERTBUTYLPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)METHYL)NPHENYL135TRIAZINE24DIAMINE
6((5(4TERTBUTYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYLMETHYL)2NPHENYL135TRIAZINE24DIAMINE
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=NC(=NC(=N4)NC5=CC=CC=C5)N
InChI=1SC28H28N8Sc128(23)20161419(151720)24343527(36(24)22128591322)3718233125(29)3326(3223)3021106471121h417H18H213H3(H32930313233)
MFCD01414984
ZINC000003666679
ZINC03666679
ZINC3666679
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