4-[(2S)-3-(4-ethanoylpiperazin-1-yl)-2-(naphthalen-2-ylsulfonylamino)-3-oxidanylidene-propyl]benzenecarboximidamide

Systemtic Name: 4-[(2S)-3-(4-ethanoylpiperazin-1-yl)-2-(naphthalen-2-ylsulfonylamino)-3-oxidanylidene-propyl]benzenecarboximidamide Openeye Name: 4-[(2S)-3-(4-acetylpiperazin-1-yl)-2-(2-naphthylsulfonylamino)-3-oxo-propyl]benzamidine CAS Name: 4-[(2S)-3-(4-acetyl-1-piperazinyl)-2-(2-naphthalenylsulfonylamino)-3-oxopropyl]benzenecarboximidamide IUPAC Name: 4-[(2S)-3-(4-acetylpiperazin-1-yl)-2-(naphthalen-2-ylsulfonylamino)-3-oxopropyl]benzenecarboximidamide Traditional Name: 4-[(2S)-3-(4-acetylpiperazino)-3-keto-2-(2-naphthylsulfonylamino)propyl]benzamidine Formula: C26H29N5O4S MolecularWeight: 507.60456

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C(CC2=CC=C(C=C2)C(=N)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)[C@H](CC2=CC=C(C=C2)C(=N)N)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H29N5O4S/c1-18(32)30-12-14-31(15-13-30)26(33)24(16-19-6-8-21(9-7-19)25(27)28)29-36(34,35)23-11-10-20-4-2-3-5-22(20)17-23/h2-11,17,24,29H,12-16H2,1H3,(H3,27,28)/t24-/m0/s1