[(1S)-1-[2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]phenyl]ethyl]azanium Openeye Name: [(1S)-1-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]phenyl]ethyl]ammonium CAS Name: [(1S)-1-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]phenyl]ethyl]azanium Traditional Name: [(1S)-1-[2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]phenyl]ethyl]ammonium Formula: C15H20N3OS+ MolecularWeight: 290.4038

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC2=CC=CC=C2C(C)[NH3+]

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SC2=CC=CC=C2[C@H](C)[NH3+]

InChI

InChI=1S/C15H19N3OS/c1-3-6-11-9-14(19)18-15(17-11)20-13-8-5-4-7-12(13)10(2)16/h4-5,7-10H,3,6,16H2,1-2H3,(H,17,18,19)/p+1/t10-/m0/s1