ethyl 3,5-bis(4-chlorophenyl)-2-[(4-nitrophenyl)sulfanylamino]benzoate

Systemtic Name: ethyl 3,5-bis(4-chlorophenyl)-2-[(4-nitrophenyl)sulfanylamino]benzoate Openeye Name: ethyl 3,5-bis(4-chlorophenyl)-2-[(4-nitrophenyl)sulfanylamino]benzoate CAS Name: 3,5-bis(4-chlorophenyl)-2-[[(4-nitrophenyl)thio]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3,5-bis(4-chlorophenyl)-2-[(4-nitrophenyl)sulfanylamino]benzoate Traditional Name: 3,5-bis(4-chlorophenyl)-2-[[(4-nitrophenyl)thio]amino]benzoic acid ethyl ester Formula: C27H20Cl2N2O4S MolecularWeight: 539.4297

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1NSC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1NSC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C27H20Cl2N2O4S/c1-2-35-27(32)25-16-19(17-3-7-20(28)8-4-17)15-24(18-5-9-21(29)10-6-18)26(25)30-36-23-13-11-22(12-14-23)31(33)34/h3-16,30H,2H2,1H3