4-chloranyl-N-[(3-hexoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 4-chloranyl-N-[(3-hexoxyphenyl)carbamothioyl]benzamide Openeye Name: 4-chloro-N-[(3-hexoxyphenyl)carbamothioyl]benzamide CAS Name: 4-chloro-N-[(3-hexoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[(3-hexoxyphenyl)carbamothioyl]benzamide Traditional Name: 4-chloro-N-[(3-hexoxyphenyl)thiocarbamoyl]benzamide Formula: C20H23ClN2O2S MolecularWeight: 390.92682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H23ClN2O2S/c1-2-3-4-5-13-25-18-8-6-7-17(14-18)22-20(26)23-19(24)15-9-11-16(21)12-10-15/h6-12,14H,2-5,13H2,1H3,(H2,22,23,24,26)