Vitas-M small molecule compound
(4Z)-4-[2-(2,6-dichloro-4-nitrophenyl)hydrazinylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-1-carbothioamide
Catalog ID
STK002479
SMILES NC(=S)N1N=C(/C(=N/Nc2c(Cl)cc(cc2Cl)[N+](=O)[O-])/C1=O)C
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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 C11H8Cl2N6O3S MW 375.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H8Cl2N6O3S/c1-4-8(10(20)18(17-4)11(14)23)15-16-9-6(12)2-5(19(21)22)3-7(9)13/h2-3,16H,1H3,(H2,14,23)/b15-8-InChIKey
ASIUPUUVNQNFQY-NVNXTCNLSA-NSynonyms
(4Z)4((26DICHLORO4NITROPHENYL)HYDRAZINYLIDENE)3METHYL5OXOPYRAZOLE1CARBOTHIOAMIDE
(4Z)4(2(26DICHLORO4NITROPHENYL)HYDRAZINYLIDENE)3METHYL5OXO45DIHYDRO1HPYRAZOLE1CARBOTHIOAMIDE
CC1=NN(C(=O)C1=NNC2=C(C=C(C=C2Cl)(N+)(=O)(O))Cl)C(=S)N
InChI=1SC11H8Cl2N6O3Sc148(10(20)18(174)11(14)23)151696(12)25(19(21)22)37(9)13h2316H1H3(H21423)b158
MFCD02026044
NC(=S)N1N=C(C(=NNc2c(Cl)cc(cc2Cl)(N+)(=O)(O))C1=O)C
STK002479
ZINC000100150396
ZINC100150399
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