Vitas-M small molecule compound

(3-amino-4H-1,2,4-triazol-4-yl)[1-(naphthalen-2-ylsulfonyl)pyrrolidin-2-yl]methanone

Catalog ID
STK260280
SMILES O=C(C1CCCN1S(=O)(=O)c1ccc2c(c1)cccc2)n1cnnc1N

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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 C17H17N5O3S MW 371.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O3S/c18-17-20-19-11-21(17)16(23)15-6-3-9-22(15)26(24,25)14-8-7-12-4-1-2-5-13(12)10-14/h1-2,4-5,7-8,10-11,15H,3,6,9H2,(H2,18,20)
InChIKey
KJQJIUDHHXHXRM-UHFFFAOYSA-N
Synonyms
1009239-55-7
(3amino124triazol4yl)(1naphthalen2ylsulfonylpyrrolidin2yl)methanone
(3amino4H124triazol4yl)(1(naphthalen2ylsulfonyl)pyrrolidin2yl)methanone
1009239557
C1CC(N(C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)N4C=NN=C4N
InChI=1SC17H17N5O3Sc181720191121(17)16(23)1563922(15)26(2425)148712412513(12)1014h124578101115H369H2(H21820)
MFCD08681253
ZINC000007669659
ZINC000007669661

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.