ethyl 4-[2-[3-[(3-chlorophenyl)carbonylamino]phenyl]sulfanylpropanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[3-[(3-chlorophenyl)carbonylamino]phenyl]sulfanylpropanoylamino]benzoate Openeye Name: ethyl 4-[2-[3-[(3-chlorobenzoyl)amino]phenyl]sulfanylpropanoylamino]benzoate CAS Name: 4-[[2-[[3-[[(3-chlorophenyl)-oxomethyl]amino]phenyl]thio]-1-oxopropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[3-[(3-chlorobenzoyl)amino]phenyl]sulfanylpropanoylamino]benzoate Traditional Name: 4-[2-[[3-[(3-chlorobenzoyl)amino]phenyl]thio]propanoylamino]benzoic acid ethyl ester Formula: C25H23ClN2O4S MolecularWeight: 482.97912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C25H23ClN2O4S/c1-3-32-25(31)17-10-12-20(13-11-17)27-23(29)16(2)33-22-9-5-8-21(15-22)28-24(30)18-6-4-7-19(26)14-18/h4-16H,3H2,1-2H3,(H,27,29)(H,28,30)