Vitas-M small molecule compound

N-(4-bromo-2-chlorophenyl)-2-{[4-ethyl-5-(3-nitrophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide

Catalog ID
STK130633
SMILES CCn1c(SCC(=O)Nc2ccc(cc2Cl)Br)nnc1c1cccc(c1)[N+](=O)[O-]

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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 C18H15BrClN5O3S MW 496.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15BrClN5O3S/c1-2-24-17(11-4-3-5-13(8-11)25(27)28)22-23-18(24)29-10-16(26)21-15-7-6-12(19)9-14(15)20/h3-9H,2,10H2,1H3,(H,21,26)
InChIKey
OTURXLANHBVEAZ-UHFFFAOYSA-N
Synonyms

CCN1C(=NN=C1SCC(=O)NC2=C(C=C(C=C2)Br)Cl)C3=CC(=CC=C3)(N+)(=O)(O)
CCn1c(SCC(=O)Nc2ccc(cc2Cl)Br)nnc1c1cccc(c1)(N+)(=O)(O)
InChI=1SC18H15BrClN5O3Sc122417(1143513(811)25(27)28)222318(24)291016(26)21157612(19)914(15)20h39H210H21H3(H2126)
MFCD04349086
N(4BROMO2CHLOROPHENYL)2((4ETHYL5(3NITROPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4BROMO2CHLOROPHENYL)2((4ETHYL5(3NITROPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002849123
ZINC02849123
ZINC2849123

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Available files

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