5-[[4-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]carbonylphenoxy]methyl]thiophene-2-carbonitrile

Systemtic Name: 5-[[4-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]carbonylphenoxy]methyl]thiophene-2-carbonitrile Openeye Name: 5-[[4-[2-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carbonyl]phenoxy]methyl]thiophene-2-carbonitrile CAS Name: 5-[[4-[oxo-[2-(1-pyrrolidinylmethyl)-1-pyrrolidinyl]methyl]phenoxy]methyl]-2-thiophenecarbonitrile IUPAC Name: 5-[[4-[2-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carbonyl]phenoxy]methyl]thiophene-2-carbonitrile Traditional Name: 5-[[4-[2-(pyrrolidinomethyl)pyrrolidine-1-carbonyl]phenoxy]methyl]thiophene-2-carbonitrile Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2CCCN2C(=O)C3=CC=C(C=C3)OCC4=CC=C(S4)C#N

Isomeric SMILES

C1CCN(C1)CC2CCCN2C(=O)C3=CC=C(C=C3)OCC4=CC=C(S4)C#N

InChI

InChI=1S/C22H25N3O2S/c23-14-20-9-10-21(28-20)16-27-19-7-5-17(6-8-19)22(26)25-13-3-4-18(25)15-24-11-1-2-12-24/h5-10,18H,1-4,11-13,15-16H2