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

Systemtic Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-2-methoxy-benzamide Openeye Name: N-[(4-butoxy-3-methoxy-phenyl)methylcarbamothioyl]-2-methoxy-benzamide CAS Name: N-[[(4-butoxy-3-methoxyphenyl)methylamino]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: N-[(4-butoxy-3-methoxyphenyl)methylcarbamothioyl]-2-methoxybenzamide Traditional Name: N-[(4-butoxy-3-methoxy-benzyl)thiocarbamoyl]-2-methoxy-benzamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=S)NC(=O)C2=CC=CC=C2OC)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=S)NC(=O)C2=CC=CC=C2OC)OC

InChI

InChI=1S/C21H26N2O4S/c1-4-5-12-27-18-11-10-15(13-19(18)26-3)14-22-21(28)23-20(24)16-8-6-7-9-17(16)25-2/h6-11,13H,4-5,12,14H2,1-3H3,(H2,22,23,24,28)