2-(4-chlorophenyl)sulfanyl-5-nitro-N-propyl-benzamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-5-nitro-N-propyl-benzamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-5-nitro-N-propyl-benzamide CAS Name: 2-[(4-chlorophenyl)thio]-5-nitro-N-propylbenzamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-5-nitro-N-propylbenzamide Traditional Name: 2-[(4-chlorophenyl)thio]-5-nitro-N-propyl-benzamide Formula: C16H15ClN2O3S MolecularWeight: 350.8199

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClN2O3S/c1-2-9-18-16(20)14-10-12(19(21)22)5-8-15(14)23-13-6-3-11(17)4-7-13/h3-8,10H,2,9H2,1H3,(H,18,20)