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

Systemtic Name: 3-[(2S)-2-(naphthalen-2-ylsulfonylamino)-3-oxidanylidene-3-piperidin-1-yl-propyl]benzenecarboximidamide Openeye Name: 3-[(2S)-2-(2-naphthylsulfonylamino)-3-oxo-3-(1-piperidyl)propyl]benzamidine CAS Name: 3-[(2S)-2-(2-naphthalenylsulfonylamino)-3-oxo-3-(1-piperidinyl)propyl]benzenecarboximidamide IUPAC Name: 3-[(2S)-2-(naphthalen-2-ylsulfonylamino)-3-oxo-3-piperidin-1-ylpropyl]benzenecarboximidamide Traditional Name: 3-[(2S)-3-keto-2-(2-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=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CCN(CC1)C(=O)[C@H](CC2=CC=CC(=C2)C(=N)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H28N4O3S/c26-24(27)21-10-6-7-18(15-21)16-23(25(30)29-13-4-1-5-14-29)28-33(31,32)22-12-11-19-8-2-3-9-20(19)17-22/h2-3,6-12,15,17,23,28H,1,4-5,13-14,16H2,(H3,26,27)/t23-/m0/s1