Vitas-M small molecule compound
N-(1-benzyl-1H-pyrazol-3-yl)-5-[2-(3-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STL394285
SMILES [O-][N+](=O)c1ccn(n1)CCc1nnc(s1)Nc1ccn(n1)Cc1ccccc1
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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 C17H16N8O2S MW 396.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N8O2S/c26-25(27)15-7-10-23(22-15)11-8-16-19-20-17(28-16)18-14-6-9-24(21-14)12-13-4-2-1-3-5-13/h1-7,9-10H,8,11-12H2,(H,18,20,21)InChIKey
IFIGNHWYBIZBNA-UHFFFAOYSA-NSynonyms
1005670-97-2(O)(N+)(=O)c1ccn(n1)CCc1nnc(s1)Nc1ccn(n1)Cc1ccccc1
1005670972
C1=CC=C(C=C1)CN2C=CC(=N2)NC3=NN=C(S3)CCN4C=CC(=N4)(N+)(=O)(O)
InChI=1SC17H16N8O2Sc2625(27)1571023(2215)11816192017(2816)18146924(2114)12134213513h17910H81112H2(H182021)
MFCD04140842
N(1BENZYL1HPYRAZOL3YL)5(2(3NITRO1HPYRAZOL1YL)ETHYL)134THIADIAZOL2AMINE
N(1benzylpyrazol3yl)5(2(3nitropyrazol1yl)ethyl)134thiadiazol2amine
ZINC000002732196
ZINC02732196
ZINC2732196
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