(4S)-4-(4-bromophenyl)-2-methyl-N-phenyl-4,10-dihydro-1H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxamide

Systemtic Name: (4S)-4-(4-bromophenyl)-2-methyl-N-phenyl-4,10-dihydro-1H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxamide Openeye Name: (4S)-4-(4-bromophenyl)-2-methyl-N-phenyl-4,10-dihydro-1H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxamide CAS Name: (4S)-4-(4-bromophenyl)-2-methyl-N-phenyl-4,10-dihydro-1H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxamide IUPAC Name: (4S)-4-(4-bromophenyl)-2-methyl-N-phenyl-4,10-dihydro-1H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxamide Traditional Name: (4S)-4-(4-bromophenyl)-2-methyl-N-phenyl-4,10-dihydro-1H-pyrimido[1,2-a]benzimidazol-5-ium-3-carboxamide Formula: C24H20BrN4O+ MolecularWeight: 460.3458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C([N+]2=C(N1)NC3=CC=CC=C32)C4=CC=C(C=C4)Br)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CC1=C([C@@H]([N+]2=C(N1)NC3=CC=CC=C32)C4=CC=C(C=C4)Br)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C24H19BrN4O/c1-15-21(23(30)27-18-7-3-2-4-8-18)22(16-11-13-17(25)14-12-16)29-20-10-6-5-9-19(20)28-24(29)26-15/h2-14,22H,1H3,(H2,26,27,28,30)/p+1/t22-/m0/s1