N-[3-[(4-phenylphenyl)carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-[(4-phenylphenyl)carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[3-[(4-phenylbenzoyl)carbamothioylamino]phenyl]benzofuran-2-carboxamide CAS Name: N-[3-[[[[oxo-(4-phenylphenyl)methyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[3-[(4-phenylbenzoyl)carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[3-[(4-phenylbenzoyl)thiocarbamoylamino]phenyl]coumarilamide Formula: C29H21N3O3S MolecularWeight: 491.56034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=CC(=C3)NC(=O)C4=CC5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NC(=S)NC3=CC=CC(=C3)NC(=O)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C29H21N3O3S/c33-27(21-15-13-20(14-16-21)19-7-2-1-3-8-19)32-29(36)31-24-11-6-10-23(18-24)30-28(34)26-17-22-9-4-5-12-25(22)35-26/h1-18H,(H,30,34)(H2,31,32,33,36)