2-[(5,7-dimethyl-1H-imidazo[1,2-a]pyrimidin-4-ium-2-yl)methylsulfanyl]-1,3-benzoxazole

Systemtic Name: 2-[(5,7-dimethyl-1H-imidazo[1,2-a]pyrimidin-4-ium-2-yl)methylsulfanyl]-1,3-benzoxazole Openeye Name: 2-[(5,7-dimethyl-1H-imidazo[1,2-a]pyrimidin-4-ium-2-yl)methylsulfanyl]-1,3-benzoxazole CAS Name: 2-[(5,7-dimethyl-1H-imidazo[1,2-a]pyrimidin-4-ium-2-yl)methylthio]-1,3-benzoxazole IUPAC Name: 2-[(5,7-dimethyl-1H-imidazo[1,2-a]pyrimidin-4-ium-2-yl)methylsulfanyl]-1,3-benzoxazole Traditional Name: 2-[(5,7-dimethyl-1H-imidazo[1,2-a]pyrimidin-4-ium-2-yl)methylthio]-1,3-benzoxazole Formula: C16H15N4OS+ MolecularWeight: 311.3815

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2C=C(NC2=N1)CSC3=NC4=CC=CC=C4O3)C

Isomeric SMILES

CC1=CC(=[N+]2C=C(NC2=N1)CSC3=NC4=CC=CC=C4O3)C

InChI

InChI=1S/C16H14N4OS/c1-10-7-11(2)20-8-12(18-15(20)17-10)9-22-16-19-13-5-3-4-6-14(13)21-16/h3-8H,9H2,1-2H3/p+1