4-(4-chlorophenyl)sulfanyl-N-(3-nitrophenyl)butanamide

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-N-(3-nitrophenyl)butanamide Openeye Name: 4-(4-chlorophenyl)sulfanyl-N-(3-nitrophenyl)butanamide CAS Name: 4-[(4-chlorophenyl)thio]-N-(3-nitrophenyl)butanamide IUPAC Name: 4-(4-chlorophenyl)sulfanyl-N-(3-nitrophenyl)butanamide Traditional Name: 4-[(4-chlorophenyl)thio]-N-(3-nitrophenyl)butyramide Formula: C16H15ClN2O3S MolecularWeight: 350.8199

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H15ClN2O3S/c17-12-6-8-15(9-7-12)23-10-2-5-16(20)18-13-3-1-4-14(11-13)19(21)22/h1,3-4,6-9,11H,2,5,10H2,(H,18,20)