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

Systemtic Name: N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-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=CC=C2OCCCCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCCCC

InChI

InChI=1S/C26H35N3O4S/c1-3-5-7-11-18-32-21-16-14-20(15-17-21)24(30)28-29-26(34)27-25(31)22-12-8-9-13-23(22)33-19-10-6-4-2/h8-9,12-17H,3-7,10-11,18-19H2,1-2H3,(H,28,30)(H2,27,29,31,34)