5-[(3R)-3-(aminomethyl)pyrrolidin-1-yl]-2-(2-ethylsulfanylethyl)pyridazin-3-one

Systemtic Name: 5-[(3R)-3-(aminomethyl)pyrrolidin-1-yl]-2-(2-ethylsulfanylethyl)pyridazin-3-one Openeye Name: 5-[(3R)-3-(aminomethyl)pyrrolidin-1-yl]-2-(2-ethylsulfanylethyl)pyridazin-3-one CAS Name: 5-[(3R)-3-(aminomethyl)-1-pyrrolidinyl]-2-[2-(ethylthio)ethyl]-3-pyridazinone IUPAC Name: 5-[(3R)-3-(aminomethyl)pyrrolidin-1-yl]-2-(2-ethylsulfanylethyl)pyridazin-3-one Traditional Name: 5-[(3R)-3-(aminomethyl)pyrrolidino]-2-[2-(ethylthio)ethyl]pyridazin-3-one Formula: C13H22N4OS MolecularWeight: 282.40498

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCN1C(=O)C=C(C=N1)N2CCC(C2)CN

Isomeric SMILES

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

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/t11-/m1/s1