N-[[4-(pyridin-4-ylmethyl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[[4-(pyridin-4-ylmethyl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[[4-(4-pyridylmethyl)phenyl]carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[4-(pyridin-4-ylmethyl)anilino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[[4-(pyridin-4-ylmethyl)phenyl]carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[[4-(4-pyridylmethyl)phenyl]thiocarbamoyl]coumarilamide Formula: C22H17N3O2S MolecularWeight: 387.45428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NC3=CC=C(C=C3)CC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC(=S)NC3=CC=C(C=C3)CC4=CC=NC=C4

InChI

InChI=1S/C22H17N3O2S/c26-21(20-14-17-3-1-2-4-19(17)27-20)25-22(28)24-18-7-5-15(6-8-18)13-16-9-11-23-12-10-16/h1-12,14H,13H2,(H2,24,25,26,28)