3-[3-(3-azanylpyridin-4-yl)sulfanylpropyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[3-(3-azanylpyridin-4-yl)sulfanylpropyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-[(3-amino-4-pyridyl)sulfanyl]propyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[(3-amino-4-pyridinyl)thio]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-(3-aminopyridin-4-yl)sulfanylpropyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[(3-amino-4-pyridyl)thio]propyl]-1H-benzimidazol-2-one Formula: C15H16N4OS MolecularWeight: 300.37874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)N2CCCSC3=C(C=NC=C3)N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)N2CCCSC3=C(C=NC=C3)N

InChI

InChI=1S/C15H16N4OS/c16-11-10-17-7-6-14(11)21-9-3-8-19-13-5-2-1-4-12(13)18-15(19)20/h1-2,4-7,10H,3,8-9,16H2,(H,18,20)