Vitas-M small molecule compound

2-{[4-amino-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-bromophenyl)acetamide

Catalog ID
STL339874
SMILES O=C(Nc1cccc(c1)Br)CSc1nnc(n1N)c1ccc(cc1)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 C17H16BrN5OS MW 418.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrN5OS/c1-11-5-7-12(8-6-11)16-21-22-17(23(16)19)25-10-15(24)20-14-4-2-3-13(18)9-14/h2-9H,10,19H2,1H3,(H,20,24)
InChIKey
MZYKLNKXLNEETE-UHFFFAOYSA-N
Synonyms
843625-67-2
2((4AMINO5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(3BROMOPHENYL)ACETAMIDE
2((4amino5(4methylphenyl)4H124triazol3yl)sulfanyl)N(3bromophenyl)acetamide
2((4amino5(ptolyl)4H124triazol3yl)thio)N(3bromophenyl)acetamide
2(4AMINO5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))N(3BROMOPHENYL)ACETAMIDE
843625672
CC1=CC=C(C=C1)C2=NN=C(N2N)SCC(=O)NC3=CC(=CC=C3)Br
InChI=1SC17H16BrN5OSc1115712(8611)16212217(23(16)19)251015(24)201442313(18)914h29H1019H21H3(H2024)
MFCD04014707
ZINC000002422039
ZINC02422039
ZINC2422039

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Available files

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