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

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

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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)CCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NC3=CC=CC(=C3)CCC4=CN=CC=C4

InChI

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