3,5-bis(chloranyl)-N-[(4-hexoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3,5-bis(chloranyl)-N-[(4-hexoxyphenyl)carbamothioyl]benzamide Openeye Name: 3,5-dichloro-N-[(4-hexoxyphenyl)carbamothioyl]benzamide CAS Name: 3,5-dichloro-N-[(4-hexoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dichloro-N-[(4-hexoxyphenyl)carbamothioyl]benzamide Traditional Name: 3,5-dichloro-N-[(4-hexoxyphenyl)thiocarbamoyl]benzamide Formula: C20H22Cl2N2O2S MolecularWeight: 425.37188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22Cl2N2O2S/c1-2-3-4-5-10-26-18-8-6-17(7-9-18)23-20(27)24-19(25)14-11-15(21)13-16(22)12-14/h6-9,11-13H,2-5,10H2,1H3,(H2,23,24,25,27)