ethyl 4-methyl-3-[[4-(2-phenylsulfanylethoxy)phenyl]carbonylamino]benzoate

Systemtic Name: ethyl 4-methyl-3-[[4-(2-phenylsulfanylethoxy)phenyl]carbonylamino]benzoate Openeye Name: ethyl 4-methyl-3-[[4-(2-phenylsulfanylethoxy)benzoyl]amino]benzoate CAS Name: 4-methyl-3-[[oxo-[4-[2-(phenylthio)ethoxy]phenyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-methyl-3-[[4-(2-phenylsulfanylethoxy)benzoyl]amino]benzoate Traditional Name: 4-methyl-3-[[4-[2-(phenylthio)ethoxy]benzoyl]amino]benzoic acid ethyl ester Formula: C25H25NO4S MolecularWeight: 435.5353

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C)NC(=O)C2=CC=C(C=C2)OCCSC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C)NC(=O)C2=CC=C(C=C2)OCCSC3=CC=CC=C3

InChI

InChI=1S/C25H25NO4S/c1-3-29-25(28)20-10-9-18(2)23(17-20)26-24(27)19-11-13-21(14-12-19)30-15-16-31-22-7-5-4-6-8-22/h4-14,17H,3,15-16H2,1-2H3,(H,26,27)