Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3,5-dimethylphenyl)acetamide
Catalog ID
STL026160
SMILES O=C(Nc1cc(C)cc(c1)C)CSc1nnc(n1c1ccccc1)c1ccc(cc1)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 C28H30N4OS MW 470.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4OS/c1-19-15-20(2)17-23(16-19)29-25(33)18-34-27-31-30-26(32(27)24-9-7-6-8-10-24)21-11-13-22(14-12-21)28(3,4)5/h6-17H,18H2,1-5H3,(H,29,33)InChIKey
KRWMPQOIXZTYJK-UHFFFAOYSA-NSynonyms
861635-83-82((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)N(35dimethylphenyl)acetamide
2((5(4TERTBUTYLPHENYL)4PHENYL124TRIAZOL3YL)SULFANYL)N(35DIMETHYLPHENYL)ACETAMIDE
2((5(4tertbutylphenyl)4phenyl4H124triazol3yl)sulfanyl)N(35dimethylphenyl)acetamide
2(5(4(TERTBUTYL)PHENYL)4PHENYL(124TRIAZOL3YLTHIO))N(35DIMETHYLPHENYL)ACETAMIDE
861635838
CC1=CC(=CC(=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C)C
InChI=1SC28H30N4OSc1191520(2)1723(1619)2925(33)183427313026(32(27)2497681024)21111322(141221)28(34)5h617H18H215H3(H2933)
MFCD05343060
ZINC000009309062
ZINC09309062
ZINC9309062
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