(4R)-3-methyl-5-oxidanylidene-4-[[4-(phenylcarbonyl)phenyl]diazenyl]-4H-pyrazole-1-carbothioamide

Systemtic Name: (4R)-3-methyl-5-oxidanylidene-4-[[4-(phenylcarbonyl)phenyl]diazenyl]-4H-pyrazole-1-carbothioamide Openeye Name: (4R)-4-(4-benzoylphenyl)azo-3-methyl-5-oxo-4H-pyrazole-1-carbothioamide CAS Name: (4R)-4-(4-benzoylphenyl)azo-3-methyl-5-oxo-4H-pyrazole-1-carbothioamide IUPAC Name: (4R)-4-[(4-benzoylphenyl)diazenyl]-3-methyl-5-oxo-4H-pyrazole-1-carbothioamide Traditional Name: (4R)-4-(4-benzoylphenyl)azo-5-keto-3-methyl-2-pyrazoline-1-carbothioamide Formula: C18H15N5O2S MolecularWeight: 365.409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1N=NC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)C(=S)N

Isomeric SMILES

CC1=NN(C(=O)[C@@H]1N=NC2=CC=C(C=C2)C(=O)C3=CC=CC=C3)C(=S)N

InChI

InChI=1S/C18H15N5O2S/c1-11-15(17(25)23(22-11)18(19)26)21-20-14-9-7-13(8-10-14)16(24)12-5-3-2-4-6-12/h2-10,15H,1H3,(H2,19,26)/t15-/m1/s1