3-cyclohexyl-N-[[[4-(2-methylpropoxy)phenyl]carbonylamino]carbamothioyl]propanamide

Systemtic Name: 3-cyclohexyl-N-[[[4-(2-methylpropoxy)phenyl]carbonylamino]carbamothioyl]propanamide Openeye Name: 3-cyclohexyl-N-[[(4-isobutoxybenzoyl)amino]carbamothioyl]propanamide CAS Name: 3-cyclohexyl-N-[[[[4-(2-methylpropoxy)phenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 3-cyclohexyl-N-[[[4-(2-methylpropoxy)benzoyl]amino]carbamothioyl]propanamide Traditional Name: 3-cyclohexyl-N-[[(4-isobutoxybenzoyl)amino]thiocarbamoyl]propionamide Formula: C21H31N3O3S MolecularWeight: 405.55414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)CCC2CCCCC2

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)CCC2CCCCC2

InChI

InChI=1S/C21H31N3O3S/c1-15(2)14-27-18-11-9-17(10-12-18)20(26)23-24-21(28)22-19(25)13-8-16-6-4-3-5-7-16/h9-12,15-16H,3-8,13-14H2,1-2H3,(H,23,26)(H2,22,24,25,28)