N-(2-phenylsulfanylethyl)-4-(piperidin-1-ylsulfonylmethyl)benzamide

Systemtic Name: N-(2-phenylsulfanylethyl)-4-(piperidin-1-ylsulfonylmethyl)benzamide Openeye Name: N-(2-phenylsulfanylethyl)-4-(1-piperidylsulfonylmethyl)benzamide CAS Name: N-[2-(phenylthio)ethyl]-4-(1-piperidinylsulfonylmethyl)benzamide IUPAC Name: N-(2-phenylsulfanylethyl)-4-(piperidin-1-ylsulfonylmethyl)benzamide Traditional Name: N-[2-(phenylthio)ethyl]-4-(piperidinosulfonylmethyl)benzamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NCCSC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NCCSC3=CC=CC=C3

InChI

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