N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]naphthalene-1-carboxamide Openeye Name: N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]naphthalene-1-carboxamide CAS Name: N-[[(2-phenyl-1,3-benzoxazol-5-yl)amino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: N-[(2-phenyl-1,3-benzoxazol-5-yl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: N-[(2-phenyl-1,3-benzoxazol-5-yl)thiocarbamoyl]-1-naphthamide Formula: C25H17N3O2S MolecularWeight: 423.48638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H17N3O2S/c29-23(20-12-6-10-16-7-4-5-11-19(16)20)28-25(31)26-18-13-14-22-21(15-18)27-24(30-22)17-8-2-1-3-9-17/h1-15H,(H2,26,28,29,31)