N-[[3-(phenylazanylmethyl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[[3-(phenylazanylmethyl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[[3-(anilinomethyl)phenyl]carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[3-(anilinomethyl)anilino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[[3-(anilinomethyl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[[3-(anilinomethyl)phenyl]thiocarbamoyl]coumarilamide Formula: C23H19N3O2S MolecularWeight: 401.48086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NCC2=CC(=CC=C2)NC(=S)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C(C=C1)NCC2=CC(=CC=C2)NC(=S)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C23H19N3O2S/c27-22(21-14-17-8-4-5-12-20(17)28-21)26-23(29)25-19-11-6-7-16(13-19)15-24-18-9-2-1-3-10-18/h1-14,24H,15H2,(H2,25,26,27,29)