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

Systemtic Name: N-[(2,4-dichlorophenyl)methylcarbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[(2,4-dichlorophenyl)methylcarbamothioyl]-4-heptoxy-benzamide CAS Name: N-[[(2,4-dichlorophenyl)methylamino]-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[(2,4-dichlorophenyl)methylcarbamothioyl]-4-heptoxybenzamide Traditional Name: N-[(2,4-dichlorobenzyl)thiocarbamoyl]-4-heptoxy-benzamide Formula: C22H26Cl2N2O2S MolecularWeight: 453.42504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C22H26Cl2N2O2S/c1-2-3-4-5-6-13-28-19-11-8-16(9-12-19)21(27)26-22(29)25-15-17-7-10-18(23)14-20(17)24/h7-12,14H,2-6,13,15H2,1H3,(H2,25,26,27,29)