(7-chloranyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-methyl-[(1S)-1-thiophen-2-ylethyl]azanium

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-methyl-[(1S)-1-thiophen-2-ylethyl]azanium Openeye Name: (7-chloro-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-methyl-[(1S)-1-(2-thienyl)ethyl]ammonium CAS Name: (7-chloro-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-methyl-[(1S)-1-thiophen-2-ylethyl]ammonium IUPAC Name: (7-chloro-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-methyl-[(1S)-1-thiophen-2-ylethyl]azanium Traditional Name: (7-chloro-4-keto-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl-methyl-[(1S)-1-(2-thienyl)ethyl]ammonium Formula: C16H18ClN3OS+2 MolecularWeight: 335.85162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)[NH+](C)CC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

C[C@@H](C1=CC=CS1)[NH+](C)CC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C16H16ClN3OS/c1-11(14-4-3-7-22-14)19(2)10-13-8-16(21)20-9-12(17)5-6-15(20)18-13/h3-9,11H,10H2,1-2H3/p+2/t11-/m0/s1