ethyl 4-[(2,4-dichlorophenyl)methyl-(naphthalen-2-ylcarbonylcarbamothioyl)amino]benzoate

Systemtic Name: ethyl 4-[(2,4-dichlorophenyl)methyl-(naphthalen-2-ylcarbonylcarbamothioyl)amino]benzoate Openeye Name: ethyl 4-[(2,4-dichlorophenyl)methyl-(naphthalene-2-carbonylcarbamothioyl)amino]benzoate CAS Name: 4-[(2,4-dichlorophenyl)methyl-[[[2-naphthalenyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2,4-dichlorophenyl)methyl-(naphthalene-2-carbonylcarbamothioyl)amino]benzoate Traditional Name: 4-[(2,4-dichlorobenzyl)-(2-naphthoylthiocarbamoyl)amino]benzoic acid ethyl ester Formula: C28H22Cl2N2O3S MolecularWeight: 537.45688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N(CC2=C(C=C(C=C2)Cl)Cl)C(=S)NC(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(CC2=C(C=C(C=C2)Cl)Cl)C(=S)NC(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H22Cl2N2O3S/c1-2-35-27(34)19-10-13-24(14-11-19)32(17-22-9-12-23(29)16-25(22)30)28(36)31-26(33)21-8-7-18-5-3-4-6-20(18)15-21/h3-16H,2,17H2,1H3,(H,31,33,36)