N-[(3-pyridin-2-yloxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[(3-pyridin-2-yloxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[[3-(2-pyridyloxy)phenyl]carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[3-(2-pyridinyloxy)anilino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[(3-pyridin-2-yloxyphenyl)carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[[3-(2-pyridyloxy)phenyl]thiocarbamoyl]coumarilamide Formula: C21H15N3O3S MolecularWeight: 389.4271

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NC3=CC(=CC=C3)OC4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NC3=CC(=CC=C3)OC4=CC=CC=N4

InChI

InChI=1S/C21H15N3O3S/c25-20(18-12-14-6-1-2-9-17(14)27-18)24-21(28)23-15-7-5-8-16(13-15)26-19-10-3-4-11-22-19/h1-13H,(H2,23,24,25,28)