3-[[(3S)-3-(naphthalen-1-ylsulfonylamino)-2-oxidanylidene-pyrrolidin-1-yl]methyl]benzenecarboximidamide

Systemtic Name: 3-[[(3S)-3-(naphthalen-1-ylsulfonylamino)-2-oxidanylidene-pyrrolidin-1-yl]methyl]benzenecarboximidamide Openeye Name: 3-[[(3S)-3-(1-naphthylsulfonylamino)-2-oxo-pyrrolidin-1-yl]methyl]benzamidine CAS Name: 3-[[(3S)-3-(1-naphthalenylsulfonylamino)-2-oxo-1-pyrrolidinyl]methyl]benzenecarboximidamide IUPAC Name: 3-[[(3S)-3-(naphthalen-1-ylsulfonylamino)-2-oxopyrrolidin-1-yl]methyl]benzenecarboximidamide Traditional Name: 3-[[(3S)-2-keto-3-(1-naphthylsulfonylamino)pyrrolidino]methyl]benzamidine Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1NS(=O)(=O)C2=CC=CC3=CC=CC=C32)CC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1CN(C(=O)[C@H]1NS(=O)(=O)C2=CC=CC3=CC=CC=C32)CC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C22H22N4O3S/c23-21(24)17-8-3-5-15(13-17)14-26-12-11-19(22(26)27)25-30(28,29)20-10-4-7-16-6-1-2-9-18(16)20/h1-10,13,19,25H,11-12,14H2,(H3,23,24)/t19-/m0/s1