2-(4-nitrophenyl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-(4-nitrophenyl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-(4-nitrophenyl)sulfanyl-N-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: 2-[(4-nitrophenyl)thio]-N-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(4-nitrophenyl)sulfanyl-N-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-[(4-nitrophenyl)thio]-N-(4-piperidinosulfonylphenyl)propionamide Formula: C20H23N3O5S2 MolecularWeight: 449.54372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5S2/c1-15(29-18-9-7-17(8-10-18)23(25)26)20(24)21-16-5-11-19(12-6-16)30(27,28)22-13-3-2-4-14-22/h5-12,15H,2-4,13-14H2,1H3,(H,21,24)