(4S)-4-(naphthalen-2-ylsulfonylamino)-5-oxidanylidene-5-(4-phenylpiperazin-1-yl)pentanamide

Systemtic Name: (4S)-4-(naphthalen-2-ylsulfonylamino)-5-oxidanylidene-5-(4-phenylpiperazin-1-yl)pentanamide Openeye Name: (4S)-4-(2-naphthylsulfonylamino)-5-oxo-5-(4-phenylpiperazin-1-yl)pentanamide CAS Name: (4S)-4-(2-naphthalenylsulfonylamino)-5-oxo-5-(4-phenyl-1-piperazinyl)pentanamide IUPAC Name: (4S)-4-(naphthalen-2-ylsulfonylamino)-5-oxo-5-(4-phenylpiperazin-1-yl)pentanamide Traditional Name: (4S)-5-keto-4-(2-naphthylsulfonylamino)-5-(4-phenylpiperazino)valeramide Formula: C25H28N4O4S MolecularWeight: 480.57922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)C(CCC(=O)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)[C@H](CCC(=O)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H28N4O4S/c26-24(30)13-12-23(25(31)29-16-14-28(15-17-29)21-8-2-1-3-9-21)27-34(32,33)22-11-10-19-6-4-5-7-20(19)18-22/h1-11,18,23,27H,12-17H2,(H2,26,30)/t23-/m0/s1