N-(3-acetamido-4-methoxy-phenyl)-2-(4-chlorophenyl)sulfanyl-5-nitro-benzamide

Systemtic Name: N-(3-acetamido-4-methoxy-phenyl)-2-(4-chlorophenyl)sulfanyl-5-nitro-benzamide Openeye Name: N-(3-acetamido-4-methoxy-phenyl)-2-(4-chlorophenyl)sulfanyl-5-nitro-benzamide CAS Name: N-(3-acetamido-4-methoxyphenyl)-2-[(4-chlorophenyl)thio]-5-nitrobenzamide IUPAC Name: N-(3-acetamido-4-methoxyphenyl)-2-(4-chlorophenyl)sulfanyl-5-nitrobenzamide Traditional Name: N-(3-acetamido-4-methoxy-phenyl)-2-[(4-chlorophenyl)thio]-5-nitro-benzamide Formula: C22H18ClN3O5S MolecularWeight: 471.91342

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C22H18ClN3O5S/c1-13(27)24-19-11-15(5-9-20(19)31-2)25-22(28)18-12-16(26(29)30)6-10-21(18)32-17-7-3-14(23)4-8-17/h3-12H,1-2H3,(H,24,27)(H,25,28)