N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-2-phenylsulfanyl-propanamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-2-phenylsulfanyl-propanamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-2-phenylsulfanyl-propanamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-2-(phenylthio)propanamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-phenylsulfanylpropanamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-2-(phenylthio)propionamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCN(CC1)CC(=O)N)SC2=CC=CC=C2

Isomeric SMILES

CC(C(=O)NC1CCN(CC1)CC(=O)N)SC2=CC=CC=C2

InChI

InChI=1S/C16H23N3O2S/c1-12(22-14-5-3-2-4-6-14)16(21)18-13-7-9-19(10-8-13)11-15(17)20/h2-6,12-13H,7-11H2,1H3,(H2,17,20)(H,18,21)