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

Systemtic Name: 3-[3-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]propyl]-1H-benzimidazol-2-one Formula: C16H15N5OS2 MolecularWeight: 357.4532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)N2CCCSC3=NNC(=N3)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)N2CCCSC3=NNC(=N3)C4=CC=CS4

InChI

InChI=1S/C16H15N5OS2/c22-16-17-11-5-1-2-6-12(11)21(16)8-4-10-24-15-18-14(19-20-15)13-7-3-9-23-13/h1-3,5-7,9H,4,8,10H2,(H,17,22)(H,18,19,20)