N-[(3-phenylmethoxyphenyl)carbamothioyl]-2,3-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: N-[(3-phenylmethoxyphenyl)carbamothioyl]-2,3-dihydro-1-benzofuran-2-carboxamide Openeye Name: N-[(3-benzyloxyphenyl)carbamothioyl]-2,3-dihydrobenzofuran-2-carboxamide CAS Name: N-[(3-phenylmethoxyanilino)-sulfanylidenemethyl]-2,3-dihydrobenzofuran-2-carboxamide IUPAC Name: N-[(3-phenylmethoxyphenyl)carbamothioyl]-2,3-dihydro-1-benzofuran-2-carboxamide Traditional Name: N-[(3-benzoxyphenyl)thiocarbamoyl]coumaran-2-carboxamide Formula: C23H20N2O3S MolecularWeight: 404.4815

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C21)C(=O)NC(=S)NC3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1C(OC2=CC=CC=C21)C(=O)NC(=S)NC3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H20N2O3S/c26-22(21-13-17-9-4-5-12-20(17)28-21)25-23(29)24-18-10-6-11-19(14-18)27-15-16-7-2-1-3-8-16/h1-12,14,21H,13,15H2,(H2,24,25,26,29)