N-[(3,4-dimethoxyphenyl)methylcarbamothioyl]-4-fluoranyl-benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methylcarbamothioyl]-4-fluoranyl-benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)methylcarbamothioyl]-4-fluoro-benzamide CAS Name: N-[[(3,4-dimethoxyphenyl)methylamino]-sulfanylidenemethyl]-4-fluorobenzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methylcarbamothioyl]-4-fluorobenzamide Traditional Name: 4-fluoro-N-(veratrylthiocarbamoyl)benzamide Formula: C17H17FN2O3S MolecularWeight: 348.391883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=S)NC(=O)C2=CC=C(C=C2)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=S)NC(=O)C2=CC=C(C=C2)F)OC

InChI

InChI=1S/C17H17FN2O3S/c1-22-14-8-3-11(9-15(14)23-2)10-19-17(24)20-16(21)12-4-6-13(18)7-5-12/h3-9H,10H2,1-2H3,(H2,19,20,21,24)