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

Systemtic Name: 4-bromanyl-N-[(2-naphthalen-2-yl-1,3-benzoxazol-5-yl)carbamothioyl]benzamide Openeye Name: 4-bromo-N-[[2-(2-naphthyl)-1,3-benzoxazol-5-yl]carbamothioyl]benzamide CAS Name: 4-bromo-N-[[[2-(2-naphthalenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-bromo-N-[(2-naphthalen-2-yl-1,3-benzoxazol-5-yl)carbamothioyl]benzamide Traditional Name: 4-bromo-N-[[2-(2-naphthyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]benzamide Formula: C25H16BrN3O2S MolecularWeight: 502.38244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=NC4=C(O3)C=CC(=C4)NC(=S)NC(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=NC4=C(O3)C=CC(=C4)NC(=S)NC(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C25H16BrN3O2S/c26-19-9-7-16(8-10-19)23(30)29-25(32)27-20-11-12-22-21(14-20)28-24(31-22)18-6-5-15-3-1-2-4-17(15)13-18/h1-14H,(H2,27,29,30,32)