N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-2-phenethyloxy-benzamide

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-2-phenethyloxy-benzamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-2-phenethyloxy-benzamide CAS Name: N-[[(4-butoxy-3-methoxyphenyl)methylamino]-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methylcarbamothioyl]-2-phenethyloxybenzamide Traditional Name: N-[(4-butoxy-3-methoxy-benzyl)thiocarbamoyl]-2-phenethyloxy-benzamide Formula: C28H32N2O4S MolecularWeight: 492.62968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=S)NC(=O)C2=CC=CC=C2OCCC3=CC=CC=C3)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=S)NC(=O)C2=CC=CC=C2OCCC3=CC=CC=C3)OC

InChI

InChI=1S/C28H32N2O4S/c1-3-4-17-33-25-15-14-22(19-26(25)32-2)20-29-28(35)30-27(31)23-12-8-9-13-24(23)34-18-16-21-10-6-5-7-11-21/h5-15,19H,3-4,16-18,20H2,1-2H3,(H2,29,30,31,35)