[1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]methyl-[(1S)-1-thiophen-2-ylethyl]azanium

Systemtic Name: [1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]methyl-[(1S)-1-thiophen-2-ylethyl]azanium Openeye Name: (1,3-dimethyl-2,4-dioxo-pyrimidin-5-yl)methyl-[(1S)-1-(2-thienyl)ethyl]ammonium CAS Name: (1,3-dimethyl-2,4-dioxo-5-pyrimidinyl)methyl-[(1S)-1-thiophen-2-ylethyl]ammonium IUPAC Name: (1,3-dimethyl-2,4-dioxopyrimidin-5-yl)methyl-[(1S)-1-thiophen-2-ylethyl]azanium Traditional Name: (2,4-diketo-1,3-dimethyl-pyrimidin-5-yl)methyl-[(1S)-1-(2-thienyl)ethyl]ammonium Formula: C13H18N3O2S+ MolecularWeight: 280.36592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)[NH2+]CC2=CN(C(=O)N(C2=O)C)C

Isomeric SMILES

C[C@@H](C1=CC=CS1)[NH2+]CC2=CN(C(=O)N(C2=O)C)C

InChI

InChI=1S/C13H17N3O2S/c1-9(11-5-4-6-19-11)14-7-10-8-15(2)13(18)16(3)12(10)17/h4-6,8-9,14H,7H2,1-3H3/p+1/t9-/m0/s1