N-(3-phenylsulfanylpropyl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(3-phenylsulfanylpropyl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(3-phenylsulfanylpropyl)-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[3-(phenylthio)propyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(3-phenylsulfanylpropyl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[3-(phenylthio)propyl]-3-piperidinosulfonyl-benzamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O3S2/c24-21(22-13-8-16-27-19-10-3-1-4-11-19)18-9-7-12-20(17-18)28(25,26)23-14-5-2-6-15-23/h1,3-4,7,9-12,17H,2,5-6,8,13-16H2,(H,22,24)