(4E)-4-[(2,5-dimethoxyphenyl)hydrazinylidene]-3-methyl-5-oxidanylidene-pyrazole-1-carbothioamide

Systemtic Name: (4E)-4-[(2,5-dimethoxyphenyl)hydrazinylidene]-3-methyl-5-oxidanylidene-pyrazole-1-carbothioamide Openeye Name: (4E)-4-[(2,5-dimethoxyphenyl)hydrazono]-3-methyl-5-oxo-pyrazole-1-carbothioamide CAS Name: (4E)-4-[(2,5-dimethoxyphenyl)hydrazinylidene]-3-methyl-5-oxo-1-pyrazolecarbothioamide IUPAC Name: (4E)-4-[(2,5-dimethoxyphenyl)hydrazinylidene]-3-methyl-5-oxopyrazole-1-carbothioamide Traditional Name: (4E)-4-[(2,5-dimethoxyphenyl)hydrazono]-5-keto-3-methyl-2-pyrazoline-1-carbothioamide Formula: C13H15N5O3S MolecularWeight: 321.3549

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=C(C=CC(=C2)OC)OC)C(=S)N

Isomeric SMILES

CC\1=NN(C(=O)/C1=N/NC2=C(C=CC(=C2)OC)OC)C(=S)N

InChI

InChI=1S/C13H15N5O3S/c1-7-11(12(19)18(17-7)13(14)22)16-15-9-6-8(20-2)4-5-10(9)21-3/h4-6,15H,1-3H3,(H2,14,22)/b16-11+