4-[[(2,4-dinitrophenyl)amino]methylidene]-5-methyl-2-phenyl-pyrazole-3-thione

Systemtic Name: 4-[[(2,4-dinitrophenyl)amino]methylidene]-5-methyl-2-phenyl-pyrazole-3-thione Openeye Name: 4-[(2,4-dinitroanilino)methylene]-5-methyl-2-phenyl-pyrazole-3-thione CAS Name: 4-[(2,4-dinitroanilino)methylidene]-5-methyl-2-phenyl-3-pyrazolethione IUPAC Name: 4-[(2,4-dinitroanilino)methylidene]-5-methyl-2-phenylpyrazole-3-thione Traditional Name: 4-[(2,4-dinitroanilino)methylene]-5-methyl-2-phenyl-2-pyrazoline-3-thione Formula: C17H13N5O4S MolecularWeight: 383.38122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)C1=CNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=S)C1=CNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C3=CC=CC=C3

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