2-[2-[1-(2-phenylethanoyl)pyrrolidin-2-yl]ethyl]-1-benzothiophene-5-carbonitrile

Systemtic Name: 2-[2-[1-(2-phenylethanoyl)pyrrolidin-2-yl]ethyl]-1-benzothiophene-5-carbonitrile Openeye Name: 2-[2-[1-(2-phenylacetyl)pyrrolidin-2-yl]ethyl]benzothiophene-5-carbonitrile CAS Name: 2-[2-[1-(1-oxo-2-phenylethyl)-2-pyrrolidinyl]ethyl]-1-benzothiophene-5-carbonitrile IUPAC Name: 2-[2-[1-(2-phenylacetyl)pyrrolidin-2-yl]ethyl]-1-benzothiophene-5-carbonitrile Traditional Name: 2-[2-[1-(2-phenylacetyl)pyrrolidin-2-yl]ethyl]benzothiophene-5-carbonitrile Formula: C23H22N2OS MolecularWeight: 374.49858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC2=CC=CC=C2)CCC3=CC4=C(S3)C=CC(=C4)C#N

Isomeric SMILES

C1CC(N(C1)C(=O)CC2=CC=CC=C2)CCC3=CC4=C(S3)C=CC(=C4)C#N

InChI

InChI=1S/C23H22N2OS/c24-16-18-8-11-22-19(13-18)15-21(27-22)10-9-20-7-4-12-25(20)23(26)14-17-5-2-1-3-6-17/h1-3,5-6,8,11,13,15,20H,4,7,9-10,12,14H2