2-(4-chlorophenyl)sulfanyl-5-nitro-N-piperidin-1-yl-benzamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-5-nitro-N-piperidin-1-yl-benzamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-5-nitro-N-(1-piperidyl)benzamide CAS Name: 2-[(4-chlorophenyl)thio]-5-nitro-N-(1-piperidinyl)benzamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-5-nitro-N-piperidin-1-ylbenzamide Traditional Name: 2-[(4-chlorophenyl)thio]-5-nitro-N-piperidino-benzamide Formula: C18H18ClN3O3S MolecularWeight: 391.87182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(CC1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3O3S/c19-13-4-7-15(8-5-13)26-17-9-6-14(22(24)25)12-16(17)18(23)20-21-10-2-1-3-11-21/h4-9,12H,1-3,10-11H2,(H,20,23)