2-(pyrrolidin-1-ium-1-ylmethyl)-5-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-1,3,4-oxadiazole

Systemtic Name: 2-(pyrrolidin-1-ium-1-ylmethyl)-5-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-1,3,4-oxadiazole Openeye Name: 2-(pyrrolidin-1-ium-1-ylmethyl)-5-[2-(2-thienyl)quinazolin-4-yl]sulfanyl-1,3,4-oxadiazole CAS Name: 2-(1-pyrrolidin-1-iumylmethyl)-5-[(2-thiophen-2-yl-4-quinazolinyl)thio]-1,3,4-oxadiazole IUPAC Name: 2-(pyrrolidin-1-ium-1-ylmethyl)-5-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-1,3,4-oxadiazole Traditional Name: 2-(pyrrolidin-1-ium-1-ylmethyl)-5-[[2-(2-thienyl)quinazolin-4-yl]thio]-1,3,4-oxadiazole Formula: C19H18N5OS2+ MolecularWeight: 396.50912

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=NN=C(O2)SC3=NC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1CC[NH+](C1)CC2=NN=C(O2)SC3=NC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C19H17N5OS2/c1-2-7-14-13(6-1)18(21-17(20-14)15-8-5-11-26-15)27-19-23-22-16(25-19)12-24-9-3-4-10-24/h1-2,5-8,11H,3-4,9-10,12H2/p+1