Vitas-M small molecule compound
5-(2-nitrophenyl)-N,3-diphenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
Catalog ID
STK213285
SMILES S=C(N1N=C(CC1c1ccccc1[N+](=O)[O-])c1ccccc1)Nc1ccccc1
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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 C22H18N4O2S MW 402.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O2S/c27-26(28)20-14-8-7-13-18(20)21-15-19(16-9-3-1-4-10-16)24-25(21)22(29)23-17-11-5-2-6-12-17/h1-14,21H,15H2,(H,23,29)InChIKey
DJTZIAJMJBLZNZ-UHFFFAOYSA-NSynonyms
3(2NITROPHENYL)N5DIPHENYL34DIHYDROPYRAZOLE2CARBOTHIOAMIDE
5(2NITROPHENYL)N3DIPHENYL45DIHYDRO1HPYRAZOLE1CARBOTHIOAMIDE
C1C(N(N=C1C2=CC=CC=C2)C(=S)NC3=CC=CC=C3)C4=CC=CC=C4(N+)(=O)(O)
InChI=1SC22H18N4O2Sc2726(28)2014871318(20)211519(1693141016)2425(21)22(29)2317115261217h11421H15H2(H2329)
MFCD07657502
S=C(N1N=C(CC1c1ccccc1(N+)(=O)(O))c1ccccc1)Nc1ccccc1
ZINC000004709771
ZINC000004709774
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