3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-N,5-diphenyl-pyrazolidine-1-carbothioamide

Systemtic Name: 3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-N,5-diphenyl-pyrazolidine-1-carbothioamide Openeye Name: 3-(4-oxocyclohexa-2,5-dien-1-ylidene)-N,5-diphenyl-pyrazolidine-1-carbothioamide CAS Name: 3-(4-oxo-1-cyclohexa-2,5-dienylidene)-N,5-diphenyl-1-pyrazolidinecarbothioamide IUPAC Name: 3-(4-oxocyclohexa-2,5-dien-1-ylidene)-N,5-diphenylpyrazolidine-1-carbothioamide Traditional Name: 3-(4-ketocyclohexa-2,5-dien-1-ylidene)-N,5-diphenyl-pyrazolidine-1-carbothioamide Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(NC1=C2C=CC(=O)C=C2)C(=S)NC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C(N(NC1=C2C=CC(=O)C=C2)C(=S)NC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H19N3OS/c26-19-13-11-16(12-14-19)20-15-21(17-7-3-1-4-8-17)25(24-20)22(27)23-18-9-5-2-6-10-18/h1-14,21,24H,15H2,(H,23,27)