5,7-dimethyl-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium

Systemtic Name: 5,7-dimethyl-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium Openeye Name: 5,7-dimethyl-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium CAS Name: 5,7-dimethyl-2-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-1H-imidazo[1,2-a]pyrimidin-4-ium IUPAC Name: 5,7-dimethyl-2-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]-1H-imidazo[1,2-a]pyrimidin-4-ium Traditional Name: 5,7-dimethyl-2-[[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]methyl]-1H-imidazo[1,2-a]pyrimidin-4-ium Formula: C20H20N5S+ MolecularWeight: 362.4713

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2C=C(NC2=N1)CSC3=NC(=CC(=N3)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=[N+]2C=C(NC2=N1)CSC3=NC(=CC(=N3)C)C4=CC=CC=C4)C

InChI

InChI=1S/C20H19N5S/c1-13-9-15(3)25-11-17(23-19(25)21-13)12-26-20-22-14(2)10-18(24-20)16-7-5-4-6-8-16/h4-11H,12H2,1-3H3/p+1