4-pentoxy-N-[[(2-phenylmethoxyphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 4-pentoxy-N-[[(2-phenylmethoxyphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: N-[[(2-benzyloxybenzoyl)amino]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[[oxo-(2-phenylmethoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: 4-pentoxy-N-[[(2-phenylmethoxybenzoyl)amino]carbamothioyl]benzamide Traditional Name: 4-amoxy-N-[[(2-benzoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2OCC3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=CC=CC=C2OCC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O4S/c1-2-3-9-18-33-22-16-14-21(15-17-22)25(31)28-27(35)30-29-26(32)23-12-7-8-13-24(23)34-19-20-10-5-4-6-11-20/h4-8,10-17H,2-3,9,18-19H2,1H3,(H,29,32)(H2,28,30,31,35)