3-(methylsulfinylmethyl)-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]benzamide

Systemtic Name: 3-(methylsulfinylmethyl)-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-4-yl]benzamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)-4-piperidyl]-3-(methylsulfinylmethyl)benzamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidinyl]-3-(methylsulfinylmethyl)benzamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-4-yl]-3-(methylsulfinylmethyl)benzamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)-4-piperidyl]-3-(methylsulfinylmethyl)benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CC1=CC=CC(=C1)C(=O)NC2CCN(CC2)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CS(=O)CC1=CC=CC(=C1)C(=O)NC2CCN(CC2)CC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3S/c1-29(28)16-17-6-5-7-18(14-17)22(27)24-20-10-12-25(13-11-20)15-21(26)23-19-8-3-2-4-9-19/h2-9,14,20H,10-13,15-16H2,1H3,(H,23,26)(H,24,27)