4-(2-chlorophenyl)sulfanyl-N-(2,4-dimethylphenyl)-3-nitro-benzamide

Systemtic Name: 4-(2-chlorophenyl)sulfanyl-N-(2,4-dimethylphenyl)-3-nitro-benzamide Openeye Name: 4-(2-chlorophenyl)sulfanyl-N-(2,4-dimethylphenyl)-3-nitro-benzamide CAS Name: 4-[(2-chlorophenyl)thio]-N-(2,4-dimethylphenyl)-3-nitrobenzamide IUPAC Name: 4-(2-chlorophenyl)sulfanyl-N-(2,4-dimethylphenyl)-3-nitrobenzamide Traditional Name: 4-[(2-chlorophenyl)thio]-N-(2,4-dimethylphenyl)-3-nitro-benzamide Formula: C21H17ClN2O3S MolecularWeight: 412.88928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3Cl)[N+](=O)[O-])C

InChI

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