4-heptoxy-N-(2-oxidanylpropylcarbamothioyl)benzamide

Systemtic Name: 4-heptoxy-N-(2-oxidanylpropylcarbamothioyl)benzamide Openeye Name: 4-heptoxy-N-(2-hydroxypropylcarbamothioyl)benzamide CAS Name: 4-heptoxy-N-[(2-hydroxypropylamino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-heptoxy-N-(2-hydroxypropylcarbamothioyl)benzamide Traditional Name: 4-heptoxy-N-(2-hydroxypropylthiocarbamoyl)benzamide Formula: C18H28N2O3S MolecularWeight: 352.49152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NCC(C)O

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NCC(C)O

InChI

InChI=1S/C18H28N2O3S/c1-3-4-5-6-7-12-23-16-10-8-15(9-11-16)17(22)20-18(24)19-13-14(2)21/h8-11,14,21H,3-7,12-13H2,1-2H3,(H2,19,20,22,24)