Vitas-M small molecule compound
N-[4-(butan-2-yl)phenyl]-2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL299206
SMILES CCC(c1ccc(cc1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)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 C31H36N4OS MW 512.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N4OS/c1-7-22(3)23-12-16-26(17-13-23)32-28(36)20-37-30-34-33-29(35(30)27-18-8-21(2)9-19-27)24-10-14-25(15-11-24)31(4,5)6/h8-19,22H,7,20H2,1-6H3,(H,32,36)InChIKey
ITBLSWUPDDSXBM-UHFFFAOYSA-NSynonyms
861643-96-12(5(4(TERTBUTYL)PHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))N(4(METHYLPROPYL)PHENYL)ACETAMIDE
861643961
CCC(C)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)C)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC31H36N4OSc1722(3)23121626(171323)3228(36)203730343329(35(30)2718821(2)91927)24101425(151124)31(45)6h81922H720H216H3(H3236)
MFCD05686007
N(4(butan2yl)phenyl)2((5(4tertbutylphenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)acetamide
N(4(secbutyl)phenyl)2((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)acetamide
N(4BUTAN2YLPHENYL)2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000009309183
ZINC000009309184
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