Vitas-M small molecule compound

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

Catalog ID
STK342762
SMILES Brc1ccc(cc1)Sc1cc(NC(=O)Cn2cnc(n2)[N+](=O)[O-])cc(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 C16H11BrN6O5S MW 479.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11BrN6O5S/c17-10-1-3-13(4-2-10)29-14-6-11(5-12(7-14)22(25)26)19-15(24)8-21-9-18-16(20-21)23(27)28/h1-7,9H,8H2,(H,19,24)
InChIKey
YGBMVRVJSUEGNO-UHFFFAOYSA-N
Synonyms
312635-60-2
312635602
Brc1ccc(cc1)Sc1cc(NC(=O)Cn2cnc(n2)(N+)(=O)(O))cc(c1)(N+)(=O)(O)
C1=CC(=CC=C1SC2=CC(=CC(=C2)(N+)(=O)(O))NC(=O)CN3C=NC(=N3)(N+)(=O)(O))Br
InChI=1SC16H11BrN6O5Sc17101313(4210)2914611(512(714)22(25)26)1915(24)82191816(2021)23(27)28h179H8H2(H1924)
MFCD01080877
N(3((4bromophenyl)sulfanyl)5nitrophenyl)2(3nitro1H124triazol1yl)acetamide
N(3((4bromophenyl)thio)5nitrophenyl)2(3nitro1H124triazol1yl)acetamide
N(3(4BROMOPHENYL)SULFANYL5NITROPHENYL)2(3NITRO124TRIAZOL1YL)ACETAMIDE
N(5(4BROMOPHENYLTHIO)3NITROPHENYL)2(3NITRO(124TRIAZOLYL))ACETAMIDE
ZINC000001829716
ZINC01829716
ZINC1829716

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Available files

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