4-[2,4-bis(chloranyl)phenoxy]-N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]butanamide

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]butanamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-4-(2,4-dichlorophenoxy)butanamide CAS Name: N-[[(4-butoxy-3-methoxyphenyl)methylamino]-sulfanylidenemethyl]-4-(2,4-dichlorophenoxy)butanamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methylcarbamothioyl]-4-(2,4-dichlorophenoxy)butanamide Traditional Name: N-[(4-butoxy-3-methoxy-benzyl)thiocarbamoyl]-4-(2,4-dichlorophenoxy)butyramide Formula: C23H28Cl2N2O4S MolecularWeight: 499.45042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=S)NC(=O)CCCOC2=C(C=C(C=C2)Cl)Cl)OC

InChI

InChI=1S/C23H28Cl2N2O4S/c1-3-4-11-31-20-9-7-16(13-21(20)29-2)15-26-23(32)27-22(28)6-5-12-30-19-10-8-17(24)14-18(19)25/h7-10,13-14H,3-6,11-12,15H2,1-2H3,(H2,26,27,28,32)