2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-1H-pyrimido[1,2-a]benzimidazol-4-one

Systemtic Name: 2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-1H-pyrimido[1,2-a]benzimidazol-4-one Openeye Name: 2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-1H-pyrimido[1,2-a]benzimidazol-4-one CAS Name: 2-[[(4-methyl-2-pyrimidinyl)thio]methyl]-1H-pyrimido[1,2-a]benzimidazol-4-one IUPAC Name: 2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]-1H-pyrimido[1,2-a]benzimidazol-4-one Traditional Name: 2-[[(4-methylpyrimidin-2-yl)thio]methyl]-1H-pyrimido[1,2-a]benzimidazol-4-one Formula: C16H13N5OS MolecularWeight: 323.37232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SCC2=CC(=O)N3C4=CC=CC=C4N=C3N2

Isomeric SMILES

CC1=NC(=NC=C1)SCC2=CC(=O)N3C4=CC=CC=C4N=C3N2

InChI

InChI=1S/C16H13N5OS/c1-10-6-7-17-16(18-10)23-9-11-8-14(22)21-13-5-3-2-4-12(13)20-15(21)19-11/h2-8H,9H2,1H3,(H,19,20)