N-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)carbamothioyl]-2-nitro-benzamide

Systemtic Name: N-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)carbamothioyl]-2-nitro-benzamide Openeye Name: N-[[2-(1-naphthyl)-1,3-benzoxazol-5-yl]carbamothioyl]-2-nitro-benzamide CAS Name: N-[[[2-(1-naphthalenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[(2-naphthalen-1-yl-1,3-benzoxazol-5-yl)carbamothioyl]-2-nitrobenzamide Traditional Name: N-[[2-(1-naphthyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]-2-nitro-benzamide Formula: C25H16N4O4S MolecularWeight: 468.48394

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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=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=NC4=C(O3)C=CC(=C4)NC(=S)NC(=O)C5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C25H16N4O4S/c30-23(19-9-3-4-11-21(19)29(31)32)28-25(34)26-16-12-13-22-20(14-16)27-24(33-22)18-10-5-7-15-6-1-2-8-17(15)18/h1-14H,(H2,26,28,30,34)