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

Systemtic Name: 3-[3-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one Openeye Name: 3-[3-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one CAS Name: 3-[3-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]propyl]-1H-benzimidazol-2-one IUPAC Name: 3-[3-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propyl]-1H-benzimidazol-2-one Traditional Name: 3-[3-[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]propyl]-1H-benzimidazol-2-one Formula: C20H21N5OS2 MolecularWeight: 411.54364

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCCCN3C4=CC=CC=C4NC3=O)CC5=CC=CS5

Isomeric SMILES

C1CC1N2C(=NN=C2SCCCN3C4=CC=CC=C4NC3=O)CC5=CC=CS5

InChI

InChI=1S/C20H21N5OS2/c26-19-21-16-6-1-2-7-17(16)24(19)10-4-12-28-20-23-22-18(25(20)14-8-9-14)13-15-5-3-11-27-15/h1-3,5-7,11,14H,4,8-10,12-13H2,(H,21,26)