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

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-3-ethoxy-benzamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-3-ethoxy-benzamide CAS Name: N-[[(4-butoxy-3-methoxyphenyl)methylamino]-sulfanylidenemethyl]-3-ethoxybenzamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methylcarbamothioyl]-3-ethoxybenzamide Traditional Name: N-[(4-butoxy-3-methoxy-benzyl)thiocarbamoyl]-3-ethoxy-benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O4S/c1-4-6-12-28-19-11-10-16(13-20(19)26-3)15-23-22(29)24-21(25)17-8-7-9-18(14-17)27-5-2/h7-11,13-14H,4-6,12,15H2,1-3H3,(H2,23,24,25,29)