2-(2-chloranyl-6-nitro-phenyl)sulfanyl-N-(3,4-dimethylphenyl)benzamide

Systemtic Name: 2-(2-chloranyl-6-nitro-phenyl)sulfanyl-N-(3,4-dimethylphenyl)benzamide Openeye Name: 2-(2-chloro-6-nitro-phenyl)sulfanyl-N-(3,4-dimethylphenyl)benzamide CAS Name: 2-[(2-chloro-6-nitrophenyl)thio]-N-(3,4-dimethylphenyl)benzamide IUPAC Name: 2-(2-chloro-6-nitrophenyl)sulfanyl-N-(3,4-dimethylphenyl)benzamide Traditional Name: 2-[(2-chloro-6-nitro-phenyl)thio]-N-(3,4-dimethylphenyl)benzamide Formula: C21H17ClN2O3S MolecularWeight: 412.88928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SC3=C(C=CC=C3Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2SC3=C(C=CC=C3Cl)[N+](=O)[O-])C

InChI

InChI=1S/C21H17ClN2O3S/c1-13-10-11-15(12-14(13)2)23-21(25)16-6-3-4-9-19(16)28-20-17(22)7-5-8-18(20)24(26)27/h3-12H,1-2H3,(H,23,25)