N-(2,5-dimethylphenyl)-2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-benzamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-benzamide Openeye Name: N-(2,5-dimethylphenyl)-2-(4-methylsulfanyl-3-nitro-benzoyl)benzamide CAS Name: N-(2,5-dimethylphenyl)-2-[[4-(methylthio)-3-nitrophenyl]-oxomethyl]benzamide IUPAC Name: N-(2,5-dimethylphenyl)-2-(4-methylsulfanyl-3-nitrobenzoyl)benzamide Traditional Name: N-(2,5-dimethylphenyl)-2-[4-(methylthio)-3-nitro-benzoyl]benzamide Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)SC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)SC)[N+](=O)[O-]

InChI

InChI=1S/C23H20N2O4S/c1-14-8-9-15(2)19(12-14)24-23(27)18-7-5-4-6-17(18)22(26)16-10-11-21(30-3)20(13-16)25(28)29/h4-13H,1-3H3,(H,24,27)