N-[[3-(butanoylamino)phenyl]carbamothioyl]-3-phenylmethoxy-benzamide

Systemtic Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-N-[[3-(butanoylamino)phenyl]carbamothioyl]benzamide CAS Name: N-[[3-(1-oxobutylamino)anilino]-sulfanylidenemethyl]-3-phenylmethoxybenzamide IUPAC Name: N-[[3-(butanoylamino)phenyl]carbamothioyl]-3-phenylmethoxybenzamide Traditional Name: 3-benzoxy-N-[(3-butyramidophenyl)thiocarbamoyl]benzamide Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H25N3O3S/c1-2-8-23(29)26-20-12-7-13-21(16-20)27-25(32)28-24(30)19-11-6-14-22(15-19)31-17-18-9-4-3-5-10-18/h3-7,9-16H,2,8,17H2,1H3,(H,26,29)(H2,27,28,30,32)