2-chloranyl-N-[2-(3,4-diethoxyphenyl)ethylcarbamothioyl]-4-fluoranyl-benzamide

Systemtic Name: 2-chloranyl-N-[2-(3,4-diethoxyphenyl)ethylcarbamothioyl]-4-fluoranyl-benzamide Openeye Name: 2-chloro-N-[2-(3,4-diethoxyphenyl)ethylcarbamothioyl]-4-fluoro-benzamide CAS Name: 2-chloro-N-[[2-(3,4-diethoxyphenyl)ethylamino]-sulfanylidenemethyl]-4-fluorobenzamide IUPAC Name: 2-chloro-N-[2-(3,4-diethoxyphenyl)ethylcarbamothioyl]-4-fluorobenzamide Traditional Name: 2-chloro-N-[2-(3,4-diethoxyphenyl)ethylthiocarbamoyl]-4-fluoro-benzamide Formula: C20H22ClFN2O3S MolecularWeight: 424.916683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=S)NC(=O)C2=C(C=C(C=C2)F)Cl)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=S)NC(=O)C2=C(C=C(C=C2)F)Cl)OCC

InChI

InChI=1S/C20H22ClFN2O3S/c1-3-26-17-8-5-13(11-18(17)27-4-2)9-10-23-20(28)24-19(25)15-7-6-14(22)12-16(15)21/h5-8,11-12H,3-4,9-10H2,1-2H3,(H2,23,24,25,28)