N-(4-ethoxyphenyl)-4-(4-methylphenyl)sulfanyl-3-nitro-benzamide

Systemtic Name: N-(4-ethoxyphenyl)-4-(4-methylphenyl)sulfanyl-3-nitro-benzamide Openeye Name: N-(4-ethoxyphenyl)-3-nitro-4-(p-tolylsulfanyl)benzamide CAS Name: N-(4-ethoxyphenyl)-4-[(4-methylphenyl)thio]-3-nitrobenzamide IUPAC Name: N-(4-ethoxyphenyl)-4-(4-methylphenyl)sulfanyl-3-nitrobenzamide Traditional Name: 3-nitro-N-p-phenetyl-4-(p-tolylthio)benzamide Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O4S/c1-3-28-18-9-7-17(8-10-18)23-22(25)16-6-13-21(20(14-16)24(26)27)29-19-11-4-15(2)5-12-19/h4-14H,3H2,1-2H3,(H,23,25)