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

Systemtic Name: N-[[[4-(3-methylbutoxy)phenyl]carbonylamino]carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[(4-isopentyloxybenzoyl)amino]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[[[4-(3-methylbutoxy)benzoyl]amino]carbamothioyl]-2-phenylacetamide Traditional Name: N-[[(4-isoamoxybenzoyl)amino]thiocarbamoyl]-2-phenyl-acetamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O3S/c1-15(2)12-13-27-18-10-8-17(9-11-18)20(26)23-24-21(28)22-19(25)14-16-6-4-3-5-7-16/h3-11,15H,12-14H2,1-2H3,(H,23,26)(H2,22,24,25,28)