6-azanyl-2-(1H-benzimidazol-2-ylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-(1H-benzimidazol-2-ylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 6-amino-2-(1H-benzimidazol-2-ylmethylsulfanyl)-1H-pyrimidin-4-one CAS Name: 6-amino-2-(1H-benzimidazol-2-ylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-(1H-benzimidazol-2-ylmethylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 6-amino-2-(1H-benzimidazol-2-ylmethylthio)-1H-pyrimidin-4-one Formula: C12H11N5OS MolecularWeight: 273.31364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)CSC3=NC(=O)C=C(N3)N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)CSC3=NC(=O)C=C(N3)N

InChI

InChI=1S/C12H11N5OS/c13-9-5-11(18)17-12(16-9)19-6-10-14-7-3-1-2-4-8(7)15-10/h1-5H,6H2,(H,14,15)(H3,13,16,17,18)