(2S)-4-azanyl-2-quinolin-1-ium-4-yl-2,10-dihydropyrimido[1,2-a]benzimidazole-3-carbonitrile

Systemtic Name: (2S)-4-azanyl-2-quinolin-1-ium-4-yl-2,10-dihydropyrimido[1,2-a]benzimidazole-3-carbonitrile Openeye Name: (2S)-4-amino-2-quinolin-1-ium-4-yl-2,10-dihydropyrimido[1,2-a]benzimidazole-3-carbonitrile CAS Name: (2S)-4-amino-2-(4-quinolin-1-iumyl)-2,10-dihydropyrimido[1,2-a]benzimidazole-3-carbonitrile IUPAC Name: (2S)-4-amino-2-quinolin-1-ium-4-yl-2,10-dihydropyrimido[1,2-a]benzimidazole-3-carbonitrile Traditional Name: (2S)-4-amino-2-quinolin-1-ium-4-yl-2,10-dihydropyrimido[1,2-a]benzimidazole-3-carbonitrile Formula: C20H15N6+ MolecularWeight: 339.3733

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=[NH+]2)C3C(=C(N4C5=CC=CC=C5NC4=N3)N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=[NH+]2)[C@H]3C(=C(N4C5=CC=CC=C5NC4=N3)N)C#N

InChI

InChI=1S/C20H14N6/c21-11-14-18(13-9-10-23-15-6-2-1-5-12(13)15)25-20-24-16-7-3-4-8-17(16)26(20)19(14)22/h1-10,18H,22H2,(H,24,25)/p+1/t18-/m0/s1