4-[[(4-chloranyl-2-methoxy-5-methyl-phenyl)carbamothioyl-[(4-chlorophenyl)methyl]amino]methyl]benzoate

Systemtic Name: 4-[[(4-chloranyl-2-methoxy-5-methyl-phenyl)carbamothioyl-[(4-chlorophenyl)methyl]amino]methyl]benzoate Openeye Name: 4-[[(4-chloro-2-methoxy-5-methyl-phenyl)carbamothioyl-[(4-chlorophenyl)methyl]amino]methyl]benzoate CAS Name: 4-[[[(4-chloro-2-methoxy-5-methylanilino)-sulfanylidenemethyl]-[(4-chlorophenyl)methyl]amino]methyl]benzoate IUPAC Name: 4-[[(4-chloro-2-methoxy-5-methylphenyl)carbamothioyl-[(4-chlorophenyl)methyl]amino]methyl]benzoate Traditional Name: 4-[[(4-chlorobenzyl)-[(4-chloro-2-methoxy-5-methyl-phenyl)thiocarbamoyl]amino]methyl]benzoate Formula: C24H21Cl2N2O3S- MolecularWeight: 488.40614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=S)N(CC2=CC=C(C=C2)C(=O)[O-])CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=S)N(CC2=CC=C(C=C2)C(=O)[O-])CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H22Cl2N2O3S/c1-15-11-21(22(31-2)12-20(15)26)27-24(32)28(14-17-5-9-19(25)10-6-17)13-16-3-7-18(8-4-16)23(29)30/h3-12H,13-14H2,1-2H3,(H,27,32)(H,29,30)/p-1