N-(2,5-dimethylphenyl)-2-(4-nitrophenyl)sulfanyl-benzamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-(4-nitrophenyl)sulfanyl-benzamide Openeye Name: N-(2,5-dimethylphenyl)-2-(4-nitrophenyl)sulfanyl-benzamide CAS Name: N-(2,5-dimethylphenyl)-2-[(4-nitrophenyl)thio]benzamide IUPAC Name: N-(2,5-dimethylphenyl)-2-(4-nitrophenyl)sulfanylbenzamide Traditional Name: N-(2,5-dimethylphenyl)-2-[(4-nitrophenyl)thio]benzamide Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2=CC=CC=C2SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2=CC=CC=C2SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H18N2O3S/c1-14-7-8-15(2)19(13-14)22-21(24)18-5-3-4-6-20(18)27-17-11-9-16(10-12-17)23(25)26/h3-13H,1-2H3,(H,22,24)