2-hexoxy-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 2-hexoxy-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 2-hexoxy-N-[[(4-phenylbenzoyl)amino]carbamothioyl]benzamide CAS Name: 2-hexoxy-N-[[[oxo-(4-phenylphenyl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-hexoxy-N-[[(4-phenylbenzoyl)amino]carbamothioyl]benzamide Traditional Name: 2-hexoxy-N-[[(4-phenylbenzoyl)amino]thiocarbamoyl]benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-2-3-4-10-19-33-24-14-9-8-13-23(24)26(32)28-27(34)30-29-25(31)22-17-15-21(16-18-22)20-11-6-5-7-12-20/h5-9,11-18H,2-4,10,19H2,1H3,(H,29,31)(H2,28,30,32,34)