Vitas-M small molecule compound
N-benzyl-2-{[1,3-dimethyl-6-(3-nitrophenyl)-1H-pyrazolo[3,4-b]pyridin-4-yl]carbonyl}hydrazinecarbothioamide
Catalog ID
STL393621
SMILES S=C(NCc1ccccc1)NNC(=O)c1cc(nc2c1c(C)nn2C)c1cccc(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 C23H21N7O3S MW 475.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N7O3S/c1-14-20-18(22(31)26-27-23(34)24-13-15-7-4-3-5-8-15)12-19(25-21(20)29(2)28-14)16-9-6-10-17(11-16)30(32)33/h3-12H,13H2,1-2H3,(H,26,31)(H2,24,27,34)InChIKey
MZLDVEVSKDIPOM-UHFFFAOYSA-NSynonyms
866816-45-7(13DIMETHYL6(3NITROPHENYL)PYRAZOLO(54B)PYRIDIN4YL)N(((BENZYLAMINO)THIOXOMETHYL)AMINO)CARBOXAMIDE
1benzyl3((13dimethyl6(3nitrophenyl)pyrazolo(34b)pyridine4carbonyl)amino)thiourea
866816457
CC1=NN(C2=C1C(=CC(=N2)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)NNC(=S)NCC4=CC=CC=C4)C
InChI=1SC23H21N7O3Sc1142018(22(31)262723(34)2413157435815)1219(2521(20)29(2)2814)16961017(1116)30(32)33h312H13H212H3(H2631)(H2242734)
MFCD06197100
NBENZYL2((13DIMETHYL6(3NITROPHENYL)1HPYRAZOLO(34B)PYRIDIN4YL)CARBONYL)HYDRAZINECARBOTHIOAMIDE
S=C(NCc1ccccc1)NNC(=O)c1cc(nc2c1c(C)nn2C)c1cccc(c1)(N+)(=O)(O)
ZINC000008782507
ZINC08782507
ZINC8782507
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