2-[4-[4-oxidanylidene-6-(propan-2-ylsulfanylmethyl)-1H-pyrimidin-2-yl]piperazin-1-yl]ethylazanium

Systemtic Name: 2-[4-[4-oxidanylidene-6-(propan-2-ylsulfanylmethyl)-1H-pyrimidin-2-yl]piperazin-1-yl]ethylazanium Openeye Name: 2-[4-[6-(isopropylsulfanylmethyl)-4-oxo-1H-pyrimidin-2-yl]piperazin-1-yl]ethylammonium CAS Name: 2-[4-[4-oxo-6-[(propan-2-ylthio)methyl]-1H-pyrimidin-2-yl]-1-piperazinyl]ethylammonium IUPAC Name: 2-[4-[4-oxo-6-(propan-2-ylsulfanylmethyl)-1H-pyrimidin-2-yl]piperazin-1-yl]ethylazanium Traditional Name: 2-[4-[6-[(isopropylthio)methyl]-4-keto-1H-pyrimidin-2-yl]piperazino]ethylammonium Formula: C14H26N5OS+ MolecularWeight: 312.45414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC1=CC(=O)N=C(N1)N2CCN(CC2)CC[NH3+]

Isomeric SMILES

CC(C)SCC1=CC(=O)N=C(N1)N2CCN(CC2)CC[NH3+]

InChI

InChI=1S/C14H25N5OS/c1-11(2)21-10-12-9-13(20)17-14(16-12)19-7-5-18(4-3-15)6-8-19/h9,11H,3-8,10,15H2,1-2H3,(H,16,17,20)/p+1