(3E)-5-(2-chlorophenyl)-3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-N-phenyl-pyrazolidine-1-carbothioamide

Systemtic Name: (3E)-5-(2-chlorophenyl)-3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-N-phenyl-pyrazolidine-1-carbothioamide Openeye Name: (3E)-5-(2-chlorophenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-N-phenyl-pyrazolidine-1-carbothioamide CAS Name: (3E)-5-(2-chlorophenyl)-3-(6-oxo-1-cyclohexa-2,4-dienylidene)-N-phenyl-1-pyrazolidinecarbothioamide IUPAC Name: (3E)-5-(2-chlorophenyl)-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-N-phenylpyrazolidine-1-carbothioamide Traditional Name: (3E)-5-(2-chlorophenyl)-3-(6-ketocyclohexa-2,4-dien-1-ylidene)-N-phenyl-pyrazolidine-1-carbothioamide Formula: C22H18ClN3OS MolecularWeight: 407.91582

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(NC1=C2C=CC=CC2=O)C(=S)NC3=CC=CC=C3)C4=CC=CC=C4Cl

Isomeric SMILES

C\1C(N(N/C1=C/2\C=CC=CC2=O)C(=S)NC3=CC=CC=C3)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H18ClN3OS/c23-18-12-6-4-10-16(18)20-14-19(17-11-5-7-13-21(17)27)25-26(20)22(28)24-15-8-2-1-3-9-15/h1-13,20,25H,14H2,(H,24,28)/b19-17+