2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-bromanyl-5,7-dimethyl-imidazo[1,2-a]pyrimidine

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-bromanyl-5,7-dimethyl-imidazo[1,2-a]pyrimidine Openeye Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-bromo-5,7-dimethyl-imidazo[1,2-a]pyrimidine CAS Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-3-bromo-5,7-dimethylimidazo[1,2-a]pyrimidine IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-bromo-5,7-dimethylimidazo[1,2-a]pyrimidine Traditional Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-3-bromo-5,7-dimethyl-imidazo[1,2-a]pyrimidine Formula: C16H14BrN5S MolecularWeight: 388.28486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=NC(=C(N12)Br)CSC3=NC4=CC=CC=C4N3)C

Isomeric SMILES

CC1=CC(=NC2=NC(=C(N12)Br)CSC3=NC4=CC=CC=C4N3)C

InChI

InChI=1S/C16H14BrN5S/c1-9-7-10(2)22-14(17)13(19-15(22)18-9)8-23-16-20-11-5-3-4-6-12(11)21-16/h3-7H,8H2,1-2H3,(H,20,21)