5-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]-N-phenyl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 5-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]-N-phenyl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 5-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-N-phenyl-3,4-dihydropyrazole-2-carbothioamide CAS Name: 5-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-N-phenyl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 5-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-N-phenyl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 3-[(6-ketocyclohexa-2,4-dien-1-ylidene)methylamino]-N-phenyl-2-pyrazoline-1-carbothioamide Formula: C17H16N4OS MolecularWeight: 324.40014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1NC=C2C=CC=CC2=O)C(=S)NC3=CC=CC=C3

Isomeric SMILES

C1CN(N=C1NC=C2C=CC=CC2=O)C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C17H16N4OS/c22-15-9-5-4-6-13(15)12-18-16-10-11-21(20-16)17(23)19-14-7-2-1-3-8-14/h1-9,12H,10-11H2,(H,18,20)(H,19,23)