N-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[[2-(1-naphthyl)-1,3-benzoxazol-5-yl]carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[[2-(1-naphthalenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[[2-(1-naphthyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]coumarilamide Formula: C27H17N3O3S MolecularWeight: 463.50718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=NC4=C(O3)C=CC(=C4)NC(=S)NC(=O)C5=CC6=CC=CC=C6O5

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=NC4=C(O3)C=CC(=C4)NC(=S)NC(=O)C5=CC6=CC=CC=C6O5

InChI

InChI=1S/C27H17N3O3S/c31-25(24-14-17-7-2-4-11-22(17)32-24)30-27(34)28-18-12-13-23-21(15-18)29-26(33-23)20-10-5-8-16-6-1-3-9-19(16)20/h1-15H,(H2,28,30,31,34)