Vitas-M small molecule compound
N-(1-benzyl-1H-pyrazol-3-yl)-5-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
Catalog ID
STL399794
SMILES [O-][N+](=O)c1cnn(c1)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)14-10-18-23(12-14)9-7-16-20-21-17(28-16)19-15-6-8-24(22-15)11-13-4-2-1-3-5-13/h1-6,8,10,12H,7,9,11H2,(H,19,21,22)InChIKey
GIIIBGMPIIUZDQ-UHFFFAOYSA-NSynonyms
1005668-26-7(O)(N+)(=O)c1cnn(c1)CCc1nnc(s1)Nc1ccn(n1)Cc1ccccc1
1005668267
C1=CC=C(C=C1)CN2C=CC(=N2)NC3=NN=C(S3)CCN4C=C(C=N4)(N+)(=O)(O)
InChI=1SC17H16N8O2Sc2625(27)14101823(1214)9716202117(2816)19156824(2215)11134213513h1681012H7911H2(H192122)
MFCD04140753
N(1BENZYL1HPYRAZOL3YL)5(2(4NITRO1HPYRAZOL1YL)ETHYL)134THIADIAZOL2AMINE
N(1benzylpyrazol3yl)5(2(4nitropyrazol1yl)ethyl)134thiadiazol2amine
ZINC000002731597
ZINC02731597
ZINC2731597
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