N-[(3-benzo[e][1,3]benzoxazol-2-ylphenyl)carbamothioyl]naphthalene-2-carboxamide

Systemtic Name: N-[(3-benzo[e][1,3]benzoxazol-2-ylphenyl)carbamothioyl]naphthalene-2-carboxamide Openeye Name: N-[(3-benzo[e][1,3]benzoxazol-2-ylphenyl)carbamothioyl]naphthalene-2-carboxamide CAS Name: N-[[3-(2-benzo[e][1,3]benzoxazolyl)anilino]-sulfanylidenemethyl]-2-naphthalenecarboxamide IUPAC Name: N-[(3-benzo[e][1,3]benzoxazol-2-ylphenyl)carbamothioyl]naphthalene-2-carboxamide Traditional Name: N-[(3-benzo[e][1,3]benzoxazol-2-ylphenyl)thiocarbamoyl]-2-naphthamide Formula: C29H19N3O2S MolecularWeight: 473.54506

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)NC(=S)NC3=CC=CC(=C3)C4=NC5=C(O4)C=CC6=CC=CC=C65

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)NC(=S)NC3=CC=CC(=C3)C4=NC5=C(O4)C=CC6=CC=CC=C65

InChI

InChI=1S/C29H19N3O2S/c33-27(21-13-12-18-6-1-2-8-20(18)16-21)32-29(35)30-23-10-5-9-22(17-23)28-31-26-24-11-4-3-7-19(24)14-15-25(26)34-28/h1-17H,(H2,30,32,33,35)