3-(3-methylbutoxy)-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 3-(3-methylbutoxy)-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 3-isopentyloxy-N-[[(4-phenylbenzoyl)amino]carbamothioyl]benzamide CAS Name: 3-(3-methylbutoxy)-N-[[[oxo-(4-phenylphenyl)methyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-(3-methylbutoxy)-N-[[(4-phenylbenzoyl)amino]carbamothioyl]benzamide Traditional Name: 3-isoamoxy-N-[[(4-phenylbenzoyl)amino]thiocarbamoyl]benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-18(2)15-16-32-23-10-6-9-22(17-23)24(30)27-26(33)29-28-25(31)21-13-11-20(12-14-21)19-7-4-3-5-8-19/h3-14,17-18H,15-16H2,1-2H3,(H,28,31)(H2,27,29,30,33)