[(3R)-1-[1-(2-ethylsulfanylethyl)-6-oxidanylidene-pyridazin-4-yl]pyrrolidin-3-yl]methylazanium

Systemtic Name: [(3R)-1-[1-(2-ethylsulfanylethyl)-6-oxidanylidene-pyridazin-4-yl]pyrrolidin-3-yl]methylazanium Openeye Name: [(3R)-1-[1-(2-ethylsulfanylethyl)-6-oxo-pyridazin-4-yl]pyrrolidin-3-yl]methylammonium CAS Name: [(3R)-1-[1-[2-(ethylthio)ethyl]-6-oxo-4-pyridazinyl]-3-pyrrolidinyl]methylammonium IUPAC Name: [(3R)-1-[1-(2-ethylsulfanylethyl)-6-oxopyridazin-4-yl]pyrrolidin-3-yl]methylazanium Traditional Name: [(3R)-1-[1-[2-(ethylthio)ethyl]-6-keto-pyridazin-4-yl]pyrrolidin-3-yl]methylammonium Formula: C13H23N4OS+ MolecularWeight: 283.41292

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCN1C(=O)C=C(C=N1)N2CCC(C2)C[NH3+]

Isomeric SMILES

CCSCCN1C(=O)C=C(C=N1)N2CC[C@@H](C2)C[NH3+]

InChI

InChI=1S/C13H22N4OS/c1-2-19-6-5-17-13(18)7-12(9-15-17)16-4-3-11(8-14)10-16/h7,9,11H,2-6,8,10,14H2,1H3/p+1/t11-/m1/s1