N-(4-chlorophenyl)-5-methyl-3-oxidanylidene-2-phenyl-pyrazolidine-1-carbothioamide

Systemtic Name: N-(4-chlorophenyl)-5-methyl-3-oxidanylidene-2-phenyl-pyrazolidine-1-carbothioamide Openeye Name: N-(4-chlorophenyl)-5-methyl-3-oxo-2-phenyl-pyrazolidine-1-carbothioamide CAS Name: N-(4-chlorophenyl)-5-methyl-3-oxo-2-phenyl-1-pyrazolidinecarbothioamide IUPAC Name: N-(4-chlorophenyl)-5-methyl-3-oxo-2-phenylpyrazolidine-1-carbothioamide Traditional Name: N-(4-chlorophenyl)-3-keto-5-methyl-2-phenyl-pyrazolidine-1-carbothioamide Formula: C17H16ClN3OS MolecularWeight: 345.84644

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)N(N1C(=S)NC2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1CC(=O)N(N1C(=S)NC2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C17H16ClN3OS/c1-12-11-16(22)21(15-5-3-2-4-6-15)20(12)17(23)19-14-9-7-13(18)8-10-14/h2-10,12H,11H2,1H3,(H,19,23)