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

Systemtic Name: N-[[(2,4-dichlorophenyl)carbonylamino]carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[[(2,4-dichlorobenzoyl)amino]carbamothioyl]-4-heptoxy-benzamide CAS Name: N-[[[(2,4-dichlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[[(2,4-dichlorobenzoyl)amino]carbamothioyl]-4-heptoxybenzamide Traditional Name: N-[[(2,4-dichlorobenzoyl)amino]thiocarbamoyl]-4-heptoxy-benzamide Formula: C22H25Cl2N3O3S MolecularWeight: 482.4232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C22H25Cl2N3O3S/c1-2-3-4-5-6-13-30-17-10-7-15(8-11-17)20(28)25-22(31)27-26-21(29)18-12-9-16(23)14-19(18)24/h7-12,14H,2-6,13H2,1H3,(H,26,29)(H2,25,27,28,31)