[(2S)-butan-2-yl]-[(9-methyl-4-oxidanylidene-2-phenylazanyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylidene]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(9-methyl-4-oxidanylidene-2-phenylazanyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylidene]azanium Openeye Name: (2-anilino-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylene-[(1S)-1-methylpropyl]ammonium CAS Name: (2-anilino-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylidene-[(2S)-butan-2-yl]ammonium IUPAC Name: (2-anilino-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylidene-[(2S)-butan-2-yl]azanium Traditional Name: (2-anilino-4-keto-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-yl)methylene-[(1S)-1-methylpropyl]ammonium Formula: C20H24N4O+2 MolecularWeight: 336.43076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH+]=CC1=C(NC2=C(C=CC=[N+]2C1=O)C)NC3=CC=CC=C3

Isomeric SMILES

CC[C@H](C)[NH+]=CC1=C(NC2=C(C=CC=[N+]2C1=O)C)NC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O/c1-4-15(3)21-13-17-18(22-16-10-6-5-7-11-16)23-19-14(2)9-8-12-24(19)20(17)25/h5-13,15H,4H2,1-3H3,(H,21,22,25)/p+2/t15-/m0/s1