3-[3-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-1H-benzimidazol-2-one

Systemtic Name: 3-[3-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]propyl]-1H-benzimidazol-2-one Formula: C16H16N6OS2 MolecularWeight: 372.46784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)N2CCCSC3=NN=C(N3N)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)N2CCCSC3=NN=C(N3N)C4=CC=CS4

InChI

InChI=1S/C16H16N6OS2/c17-22-14(13-7-3-9-24-13)19-20-16(22)25-10-4-8-21-12-6-2-1-5-11(12)18-15(21)23/h1-3,5-7,9H,4,8,10,17H2,(H,18,23)