5-(3,4-dimethylphenyl)-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(3,4-dimethylphenyl)-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole-2-thione Openeye Name: 5-(3,4-dimethylphenyl)-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole-2-thione CAS Name: 5-(3,4-dimethylphenyl)-3-(1-pyrrolidin-1-iumylmethyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(3,4-dimethylphenyl)-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole-2-thione Traditional Name: 5-(3,4-dimethylphenyl)-3-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazole-2-thione Formula: C15H20N3OS+ MolecularWeight: 290.4038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=S)O2)C[NH+]3CCCC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=S)O2)C[NH+]3CCCC3)C

InChI

InChI=1S/C15H19N3OS/c1-11-5-6-13(9-12(11)2)14-16-18(15(20)19-14)10-17-7-3-4-8-17/h5-6,9H,3-4,7-8,10H2,1-2H3/p+1