4-(2-chlorophenyl)sulfanyl-N-(2-ethylphenyl)-3-nitro-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H17ClN2O3S/c1-2-14-7-3-5-9-17(14)23-21(25)15-11-12-20(18(13-15)24(26)27)28-19-10-6-4-8-16(19)22/h3-13H,2H2,1H3,(H,23,25)