N-[1-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]carbonylpiperidin-4-yl]benzamide

Systemtic Name: N-[1-[2-(4-chlorophenyl)sulfanyl-5-nitro-phenyl]carbonylpiperidin-4-yl]benzamide Openeye Name: N-[1-[2-(4-chlorophenyl)sulfanyl-5-nitro-benzoyl]-4-piperidyl]benzamide CAS Name: N-[1-[[2-[(4-chlorophenyl)thio]-5-nitrophenyl]-oxomethyl]-4-piperidinyl]benzamide IUPAC Name: N-[1-[2-(4-chlorophenyl)sulfanyl-5-nitrobenzoyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[2-[(4-chlorophenyl)thio]-5-nitro-benzoyl]-4-piperidyl]benzamide Formula: C25H22ClN3O4S MolecularWeight: 495.97788

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=CC=C2)C(=O)C3=C(C=CC(=C3)[N+](=O)[O-])SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H22ClN3O4S/c26-18-6-9-21(10-7-18)34-23-11-8-20(29(32)33)16-22(23)25(31)28-14-12-19(13-15-28)27-24(30)17-4-2-1-3-5-17/h1-11,16,19H,12-15H2,(H,27,30)