N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]-2-methyl-propanamide

Systemtic Name: N-[[(4-hexoxyphenyl)carbonylamino]carbamothioyl]-2-methyl-propanamide Openeye Name: N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-2-methyl-propanamide CAS Name: N-[[[(4-hexoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-methylpropanamide IUPAC Name: N-[[(4-hexoxybenzoyl)amino]carbamothioyl]-2-methylpropanamide Traditional Name: N-[[(4-hexoxybenzoyl)amino]thiocarbamoyl]-2-methyl-propionamide Formula: C18H27N3O3S MolecularWeight: 365.49028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C(C)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C(C)C

InChI

InChI=1S/C18H27N3O3S/c1-4-5-6-7-12-24-15-10-8-14(9-11-15)17(23)20-21-18(25)19-16(22)13(2)3/h8-11,13H,4-7,12H2,1-3H3,(H,20,23)(H2,19,21,22,25)