[[(3S)-2,5-bis(oxidanylidene)-1-phenethyl-pyrrolidin-3-yl]sulfanyl-(ethylamino)methylidene]-ethyl-azanium

Systemtic Name: [[(3S)-2,5-bis(oxidanylidene)-1-phenethyl-pyrrolidin-3-yl]sulfanyl-(ethylamino)methylidene]-ethyl-azanium Openeye Name: [[(3S)-2,5-dioxo-1-phenethyl-pyrrolidin-3-yl]sulfanyl-(ethylamino)methylene]-ethyl-ammonium CAS Name: [[[(3S)-2,5-dioxo-1-phenethyl-3-pyrrolidinyl]thio]-(ethylamino)methylidene]-ethylammonium IUPAC Name: [[(3S)-2,5-dioxo-1-phenethylpyrrolidin-3-yl]sulfanyl-(ethylamino)methylidene]-ethylazanium Traditional Name: [[[(3S)-2,5-diketo-1-phenethyl-pyrrolidin-3-yl]thio]-(ethylamino)methylene]-ethyl-ammonium Formula: C17H24N3O2S+ MolecularWeight: 334.45636

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=[NH+]CC)SC1CC(=O)N(C1=O)CCC2=CC=CC=C2

Isomeric SMILES

CCNC(=[NH+]CC)S[C@H]1CC(=O)N(C1=O)CCC2=CC=CC=C2

InChI

InChI=1S/C17H23N3O2S/c1-3-18-17(19-4-2)23-14-12-15(21)20(16(14)22)11-10-13-8-6-5-7-9-13/h5-9,14H,3-4,10-12H2,1-2H3,(H,18,19)/p+1/t14-/m0/s1