Vitas-M small molecule compound

N-(2-bromo-4-methylphenyl)-2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STL299123
SMILES O=C(Nc1ccc(cc1Br)C)CSc1nnc(n1C)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 C22H25BrN4OS MW 473.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25BrN4OS/c1-14-6-11-18(17(23)12-14)24-19(28)13-29-21-26-25-20(27(21)5)15-7-9-16(10-8-15)22(2,3)4/h6-12H,13H2,1-5H3,(H,24,28)
InChIKey
LRBDGNUYXDJESR-UHFFFAOYSA-N
Synonyms
861115-09-5
2(5(4(TERTBUTYL)PHENYL)4METHYL(124TRIAZOL3YLTHIO))N(2BROMO4METHYLPHENYL)ACETAMIDE
861115095
CC1=CC(=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC=C(C=C3)C(C)(C)C)Br
InChI=1SC22H25BrN4OSc11461118(17(23)1214)2419(28)132921262520(27(21)5)157916(10815)22(23)4h612H13H215H3(H2428)
MFCD05682700
N(2bromo4methylphenyl)2((5(4(tertbutyl)phenyl)4methyl4H124triazol3yl)thio)acetamide
N(2BROMO4METHYLPHENYL)2((5(4TERTBUTYLPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2bromo4methylphenyl)2((5(4tertbutylphenyl)4methyl4H124triazol3yl)sulfanyl)acetamide
ZINC000009307395
ZINC09307395
ZINC9307395

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Available files

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