Vitas-M small molecule compound
N-[1-(2-chlorobenzyl)-1H-pyrazol-3-yl]-5-{5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}-1,3,4-thiadiazol-2-amine
Catalog ID
STK313412
SMILES Clc1ccccc1Cn1ccc(n1)Nc1nnc(s1)c1ccc(o1)Cn1ncc(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 C20H15ClN8O3S MW 482.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN8O3S/c21-16-4-2-1-3-13(16)10-27-8-7-18(26-27)23-20-25-24-19(33-20)17-6-5-15(32-17)12-28-11-14(9-22-28)29(30)31/h1-9,11H,10,12H2,(H,23,25,26)InChIKey
NUURLLSRCGWNNX-UHFFFAOYSA-NSynonyms
1005577-60-5(1((2CHLOROPHENYL)METHYL)PYRAZOL3YL)(5(5((4NITROPYRAZOLYL)METHYL)(2FURYL))(134THIADIAZOL2YL))AMINE
1005577605
C1=CC=C(C(=C1)CN2C=CC(=N2)NC3=NN=C(S3)C4=CC=C(O4)CN5C=C(C=N5)(N+)(=O)(O))Cl
Clc1ccccc1Cn1ccc(n1)Nc1nnc(s1)c1ccc(o1)Cn1ncc(c1)(N+)(=O)(O)
InChI=1SC20H15ClN8O3Sc2116421313(16)10278718(2627)2320252419(3320)176515(3217)12281114(92228)29(30)31h1911H1012H2(H232526)
MFCD04140851
N(1((2chlorophenyl)methyl)pyrazol3yl)5(5((4nitropyrazol1yl)methyl)furan2yl)134thiadiazol2amine
N(1(2chlorobenzyl)1Hpyrazol3yl)5(5((4nitro1Hpyrazol1yl)methyl)furan2yl)134thiadiazol2amine
ZINC000002732203
ZINC02732203
ZINC2732203
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