Vitas-M small molecule compound
(4Z)-4-{[(2,4-dinitrophenyl)amino]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazole-3-thione
Catalog ID
STL324049
SMILES CC1=NN(C(=S)/C/1=C\Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])c1ccccc1
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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 C17H13N5O4S MW 383.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5O4S/c1-11-14(17(27)20(19-11)12-5-3-2-4-6-12)10-18-15-8-7-13(21(23)24)9-16(15)22(25)26/h2-10,18H,1H3/b14-10-InChIKey
PYVRTTHQRUCCBV-UVTDQMKNSA-NSynonyms
(4Z)4(((24dinitrophenyl)amino)methylidene)5methyl2phenyl24dihydro3Hpyrazole3thione
(4Z)4((24DINITROANILINO)METHYLIDENE)5METHYL2PHENYLPYRAZOLE3THIONE
(Z)4(((24dinitrophenyl)amino)methylene)3methyl1phenyl1Hpyrazole5(4H)thione
4(((24DINITROPHENYL)AMINO)METHYLENE)3METHYL1PHENYL12DIAZOLINE5THIONE
CC1=NN(C(=S)C1=CNc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O))c1ccccc1
CC1=NN(C(=S)C1=CNC2=C(C=C(C=C2)(N+)(=O)(O))(N+)(=O)(O))C3=CC=CC=C3
InChI=1SC17H13N5O4Sc11114(17(27)20(1911)125324612)1018158713(21(23)24)916(15)22(25)26h21018H1H3b1410
MFCD01057789
ZINC000012413076
ZINC12413076
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