N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-3,5-bis(chloranyl)benzamide

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-3,5-bis(chloranyl)benzamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-3,5-dichloro-benzamide CAS Name: N-[[(4-butoxy-3-methoxyphenyl)methylamino]-sulfanylidenemethyl]-3,5-dichlorobenzamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methylcarbamothioyl]-3,5-dichlorobenzamide Traditional Name: N-[(4-butoxy-3-methoxy-benzyl)thiocarbamoyl]-3,5-dichloro-benzamide Formula: C20H22Cl2N2O3S MolecularWeight: 441.37128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22Cl2N2O3S/c1-3-4-7-27-17-6-5-13(8-18(17)26-2)12-23-20(28)24-19(25)14-9-15(21)11-16(22)10-14/h5-6,8-11H,3-4,7,12H2,1-2H3,(H2,23,24,25,28)