3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-N-phenyl-5-thiophen-2-yl-pyrazolidine-1-carbothioamide

Systemtic Name: 3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-N-phenyl-5-thiophen-2-yl-pyrazolidine-1-carbothioamide Openeye Name: 3-(4-oxocyclohexa-2,5-dien-1-ylidene)-N-phenyl-5-(2-thienyl)pyrazolidine-1-carbothioamide CAS Name: 3-(4-oxo-1-cyclohexa-2,5-dienylidene)-N-phenyl-5-thiophen-2-yl-1-pyrazolidinecarbothioamide IUPAC Name: 3-(4-oxocyclohexa-2,5-dien-1-ylidene)-N-phenyl-5-thiophen-2-ylpyrazolidine-1-carbothioamide Traditional Name: 3-(4-ketocyclohexa-2,5-dien-1-ylidene)-N-phenyl-5-(2-thienyl)pyrazolidine-1-carbothioamide Formula: C20H17N3OS2 MolecularWeight: 379.49848

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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=CS4

Isomeric SMILES

C1C(N(NC1=C2C=CC(=O)C=C2)C(=S)NC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C20H17N3OS2/c24-16-10-8-14(9-11-16)17-13-18(19-7-4-12-26-19)23(22-17)20(25)21-15-5-2-1-3-6-15/h1-12,18,22H,13H2,(H,21,25)