N-[4-[(4-chlorophenyl)carbamothioylamino]-2,5-diethoxy-phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[(4-chlorophenyl)carbamothioylamino]-2,5-diethoxy-phenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[(4-chlorophenyl)carbamothioylamino]-2,5-diethoxy-phenyl]-4-fluoro-benzamide CAS Name: N-[4-[[(4-chloroanilino)-sulfanylidenemethyl]amino]-2,5-diethoxyphenyl]-4-fluorobenzamide IUPAC Name: N-[4-[(4-chlorophenyl)carbamothioylamino]-2,5-diethoxyphenyl]-4-fluorobenzamide Traditional Name: N-[4-[(4-chlorophenyl)thiocarbamoylamino]-2,5-diethoxy-phenyl]-4-fluoro-benzamide Formula: C24H23ClFN3O3S MolecularWeight: 487.974123

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=C(C=C2)F)OCC)NC(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=C(C=C2)F)OCC)NC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H23ClFN3O3S/c1-3-31-21-14-20(29-24(33)27-18-11-7-16(25)8-12-18)22(32-4-2)13-19(21)28-23(30)15-5-9-17(26)10-6-15/h5-14H,3-4H2,1-2H3,(H,28,30)(H2,27,29,33)