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

Systemtic Name: 3-[3-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-[[4-methyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-[[4-methyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[[4-methyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]propyl]-1H-benzimidazol-2-one Formula: C18H19N5OS2 MolecularWeight: 385.50636

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCCN2C3=CC=CC=C3NC2=O)CC4=CC=CS4

Isomeric SMILES

CN1C(=NN=C1SCCCN2C3=CC=CC=C3NC2=O)CC4=CC=CS4

InChI

InChI=1S/C18H19N5OS2/c1-22-16(12-13-6-4-10-25-13)20-21-18(22)26-11-5-9-23-15-8-3-2-7-14(15)19-17(23)24/h2-4,6-8,10H,5,9,11-12H2,1H3,(H,19,24)