N-(2-methoxy-5-methyl-phenyl)-2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-benzamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-benzamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-2-(4-methylsulfanyl-3-nitro-benzoyl)benzamide CAS Name: N-(2-methoxy-5-methylphenyl)-2-[[4-(methylthio)-3-nitrophenyl]-oxomethyl]benzamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-2-(4-methylsulfanyl-3-nitrobenzoyl)benzamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-2-[4-(methylthio)-3-nitro-benzoyl]benzamide Formula: C23H20N2O5S MolecularWeight: 436.4803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N2O5S/c1-14-8-10-20(30-2)18(12-14)24-23(27)17-7-5-4-6-16(17)22(26)15-9-11-21(31-3)19(13-15)25(28)29/h4-13H,1-3H3,(H,24,27)