3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophene-6-carbonitrile

Systemtic Name: 3-[4-(2-piperidin-1-ylethoxy)phenyl]carbonyl-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophene-6-carbonitrile Openeye Name: 3-[4-[2-(1-piperidyl)ethoxy]benzoyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzothiophene-6-carbonitrile CAS Name: 3-[oxo-[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1-benzothiophene-6-carbonitrile IUPAC Name: 3-[4-(2-piperidin-1-ylethoxy)benzoyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophene-6-carbonitrile Traditional Name: 3-[4-(2-piperidinoethoxy)benzoyl]-2-[4-(2-pyrrolidinoethoxy)phenyl]benzothiophene-6-carbonitrile Formula: C35H37N3O3S MolecularWeight: 579.75158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)C#N)C5=CC=C(C=C5)OCCN6CCCC6

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)C#N)C5=CC=C(C=C5)OCCN6CCCC6

InChI

InChI=1S/C35H37N3O3S/c36-25-26-6-15-31-32(24-26)42-35(28-9-13-30(14-10-28)41-23-21-38-18-4-5-19-38)33(31)34(39)27-7-11-29(12-8-27)40-22-20-37-16-2-1-3-17-37/h6-15,24H,1-5,16-23H2