N-[[4-(3,6-dihydro-2H-pyridin-1-yl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[[4-(3,6-dihydro-2H-pyridin-1-yl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[[4-(3,6-dihydro-2H-pyridin-1-yl)phenyl]carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[4-(3,6-dihydro-2H-pyridin-1-yl)anilino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[[4-(3,6-dihydro-2H-pyridin-1-yl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[[4-(3,6-dihydro-2H-pyridin-1-yl)phenyl]thiocarbamoyl]coumarilamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CC=C1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H19N3O2S/c25-20(19-14-15-6-2-3-7-18(15)26-19)23-21(27)22-16-8-10-17(11-9-16)24-12-4-1-5-13-24/h1-4,6-11,14H,5,12-13H2,(H2,22,23,25,27)