N-[(4-pentylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[(4-pentylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[(4-pentylphenyl)carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[(4-pentylanilino)-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[(4-pentylphenyl)carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[(4-amylphenyl)thiocarbamoyl]coumarilamide Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C21H22N2O2S/c1-2-3-4-7-15-10-12-17(13-11-15)22-21(26)23-20(24)19-14-16-8-5-6-9-18(16)25-19/h5-6,8-14H,2-4,7H2,1H3,(H2,22,23,24,26)