3-methyl-5-oxidanylidene-4-[(4-pyrrolidin-1-ylsulfonylphenyl)hydrazinylidene]pyrazole-1-carbothioamide

Systemtic Name: 3-methyl-5-oxidanylidene-4-[(4-pyrrolidin-1-ylsulfonylphenyl)hydrazinylidene]pyrazole-1-carbothioamide Openeye Name: 3-methyl-5-oxo-4-[(4-pyrrolidin-1-ylsulfonylphenyl)hydrazono]pyrazole-1-carbothioamide CAS Name: 3-methyl-5-oxo-4-[[4-(1-pyrrolidinylsulfonyl)phenyl]hydrazinylidene]-1-pyrazolecarbothioamide IUPAC Name: 3-methyl-5-oxo-4-[(4-pyrrolidin-1-ylsulfonylphenyl)hydrazinylidene]pyrazole-1-carbothioamide Traditional Name: 5-keto-3-methyl-4-[(4-pyrrolidinosulfonylphenyl)hydrazono]-2-pyrazoline-1-carbothioamide Formula: C15H18N6O3S2 MolecularWeight: 394.47182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C(=S)N

Isomeric SMILES

CC1=NN(C(=O)C1=NNC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C(=S)N

InChI

InChI=1S/C15H18N6O3S2/c1-10-13(14(22)21(19-10)15(16)25)18-17-11-4-6-12(7-5-11)26(23,24)20-8-2-3-9-20/h4-7,17H,2-3,8-9H2,1H3,(H2,16,25)