3-butoxy-N-[(4-methoxyphenyl)methylcarbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[(4-methoxyphenyl)methylcarbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(4-methoxyphenyl)methylcarbamothioyl]benzamide CAS Name: 3-butoxy-N-[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[(4-methoxyphenyl)methylcarbamothioyl]benzamide Traditional Name: 3-butoxy-N-(p-anisylthiocarbamoyl)benzamide Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H24N2O3S/c1-3-4-12-25-18-7-5-6-16(13-18)19(23)22-20(26)21-14-15-8-10-17(24-2)11-9-15/h5-11,13H,3-4,12,14H2,1-2H3,(H2,21,22,23,26)