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

Systemtic Name: N-[[(2,4-dichlorophenyl)carbonylamino]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[[(2,4-dichlorobenzoyl)amino]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[[(2,4-dichlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[(2,4-dichlorobenzoyl)amino]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[[(2,4-dichlorobenzoyl)amino]thiocarbamoyl]benzamide Formula: C20H21Cl2N3O3S MolecularWeight: 454.37004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C20H21Cl2N3O3S/c1-2-3-4-11-28-15-8-5-13(6-9-15)18(26)23-20(29)25-24-19(27)16-10-7-14(21)12-17(16)22/h5-10,12H,2-4,11H2,1H3,(H,24,27)(H2,23,25,26,29)