2-hexoxy-N-[[[4-(3-methylbutoxy)phenyl]carbonylamino]carbamothioyl]benzamide

Systemtic Name: 2-hexoxy-N-[[[4-(3-methylbutoxy)phenyl]carbonylamino]carbamothioyl]benzamide Openeye Name: 2-hexoxy-N-[[(4-isopentyloxybenzoyl)amino]carbamothioyl]benzamide CAS Name: 2-hexoxy-N-[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-hexoxy-N-[[[4-(3-methylbutoxy)benzoyl]amino]carbamothioyl]benzamide Traditional Name: 2-hexoxy-N-[[(4-isoamoxybenzoyl)amino]thiocarbamoyl]benzamide Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OCCC(C)C

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)OCCC(C)C

InChI

InChI=1S/C26H35N3O4S/c1-4-5-6-9-17-33-23-11-8-7-10-22(23)25(31)27-26(34)29-28-24(30)20-12-14-21(15-13-20)32-18-16-19(2)3/h7-8,10-15,19H,4-6,9,16-18H2,1-3H3,(H,28,30)(H2,27,29,31,34)