N-[[(2,4-dichlorophenyl)carbonylamino]carbamothioyl]-2-hexoxy-benzamide

Systemtic Name: N-[[(2,4-dichlorophenyl)carbonylamino]carbamothioyl]-2-hexoxy-benzamide Openeye Name: N-[[(2,4-dichlorobenzoyl)amino]carbamothioyl]-2-hexoxy-benzamide CAS Name: N-[[[(2,4-dichlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-hexoxybenzamide IUPAC Name: N-[[(2,4-dichlorobenzoyl)amino]carbamothioyl]-2-hexoxybenzamide Traditional Name: N-[[(2,4-dichlorobenzoyl)amino]thiocarbamoyl]-2-hexoxy-benzamide Formula: C21H23Cl2N3O3S MolecularWeight: 468.39662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NNC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C21H23Cl2N3O3S/c1-2-3-4-7-12-29-18-9-6-5-8-16(18)19(27)24-21(30)26-25-20(28)15-11-10-14(22)13-17(15)23/h5-6,8-11,13H,2-4,7,12H2,1H3,(H,25,28)(H2,24,26,27,30)