N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]-4-pentoxy-benzamide

Systemtic Name: N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[[(4-hexoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)OCCCCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=C(C=C2)OCCCCC

InChI

InChI=1S/C26H35N3O4S/c1-3-5-7-9-19-33-23-16-12-21(13-17-23)25(31)28-29-26(34)27-24(30)20-10-14-22(15-11-20)32-18-8-6-4-2/h10-17H,3-9,18-19H2,1-2H3,(H,28,31)(H2,27,29,30,34)