2-(4-chlorophenyl)sulfanyl-N,N-diethyl-5-nitro-benzamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N,N-diethyl-5-nitro-benzamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N,N-diethyl-5-nitro-benzamide CAS Name: 2-[(4-chlorophenyl)thio]-N,N-diethyl-5-nitrobenzamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N,N-diethyl-5-nitrobenzamide Traditional Name: 2-[(4-chlorophenyl)thio]-N,N-diethyl-5-nitro-benzamide Formula: C17H17ClN2O3S MolecularWeight: 364.84648

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C=CC(=C1)[N+](=O)[O-])SC2=CC=C(C=C2)Cl

Isomeric SMILES

CCN(CC)C(=O)C1=C(C=CC(=C1)[N+](=O)[O-])SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H17ClN2O3S/c1-3-19(4-2)17(21)15-11-13(20(22)23)7-10-16(15)24-14-8-5-12(18)6-9-14/h5-11H,3-4H2,1-2H3