[azanyl-[[(3R)-1-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methylsulfanyl]methylidene]azanium

Systemtic Name: [azanyl-[[(3R)-1-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methylsulfanyl]methylidene]azanium Openeye Name: [amino-[[(3R)-1-(4-methoxyphenyl)-5-oxo-pyrrolidin-3-yl]methylsulfanyl]methylene]ammonium CAS Name: [amino-[[(3R)-1-(4-methoxyphenyl)-5-oxo-3-pyrrolidinyl]methylthio]methylidene]ammonium IUPAC Name: [amino-[[(3R)-1-(4-methoxyphenyl)-5-oxopyrrolidin-3-yl]methylsulfanyl]methylidene]azanium Traditional Name: [amino-[[(3R)-5-keto-1-(4-methoxyphenyl)pyrrolidin-3-yl]methylthio]methylene]ammonium Formula: C13H18N3O2S+ MolecularWeight: 280.36592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC(CC2=O)CSC(=[NH2+])N

Isomeric SMILES

COC1=CC=C(C=C1)N2C[C@@H](CC2=O)CSC(=[NH2+])N

InChI

InChI=1S/C13H17N3O2S/c1-18-11-4-2-10(3-5-11)16-7-9(6-12(16)17)8-19-13(14)15/h2-5,9H,6-8H2,1H3,(H3,14,15)/p+1/t9-/m1/s1