N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]hexanamide

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]hexanamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]hexanamide CAS Name: N-[[(4-butoxy-3-methoxyphenyl)methylamino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methylcarbamothioyl]hexanamide Traditional Name: N-[(4-butoxy-3-methoxy-benzyl)thiocarbamoyl]hexanamide Formula: C19H30N2O3S MolecularWeight: 366.5181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NCC1=CC(=C(C=C1)OCCCC)OC

Isomeric SMILES

CCCCCC(=O)NC(=S)NCC1=CC(=C(C=C1)OCCCC)OC

InChI

InChI=1S/C19H30N2O3S/c1-4-6-8-9-18(22)21-19(25)20-14-15-10-11-16(17(13-15)23-3)24-12-7-5-2/h10-11,13H,4-9,12,14H2,1-3H3,(H2,20,21,22,25)