2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole

Systemtic Name: 2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole Openeye Name: 2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole CAS Name: 2-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]-5-(1-pyrrolidin-1-iumylmethyl)-1,3,4-oxadiazole IUPAC Name: 2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole Traditional Name: 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]-5-(pyrrolidin-1-ium-1-ylmethyl)-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=C3C=C(S4)C5=CC=CC=C5

Isomeric SMILES

C1CC[NH+](C1)CC2=NN=C(O2)SC3=NC=NC4=C3C=C(S4)C5=CC=CC=C5

InChI

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