3-[(2S)-2-(naphthalen-1-ylsulfonylamino)-3-oxidanylidene-3-piperidin-1-yl-propyl]benzenecarboximidamide

Systemtic Name: 3-[(2S)-2-(naphthalen-1-ylsulfonylamino)-3-oxidanylidene-3-piperidin-1-yl-propyl]benzenecarboximidamide Openeye Name: 3-[(2S)-2-(1-naphthylsulfonylamino)-3-oxo-3-(1-piperidyl)propyl]benzamidine CAS Name: 3-[(2S)-2-(1-naphthalenylsulfonylamino)-3-oxo-3-(1-piperidinyl)propyl]benzenecarboximidamide IUPAC Name: 3-[(2S)-2-(naphthalen-1-ylsulfonylamino)-3-oxo-3-piperidin-1-ylpropyl]benzenecarboximidamide Traditional Name: 3-[(2S)-3-keto-2-(1-naphthylsulfonylamino)-3-piperidino-propyl]benzamidine Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(CC2=CC=CC(=C2)C(=N)N)NS(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1CCN(CC1)C(=O)[C@H](CC2=CC=CC(=C2)C(=N)N)NS(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H28N4O3S/c26-24(27)20-11-6-8-18(16-20)17-22(25(30)29-14-4-1-5-15-29)28-33(31,32)23-13-7-10-19-9-2-3-12-21(19)23/h2-3,6-13,16,22,28H,1,4-5,14-15,17H2,(H3,26,27)/t22-/m0/s1