4-[4-[[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methyl]phenoxy]butanenitrile

Systemtic Name: 4-[4-[[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methyl]phenoxy]butanenitrile Openeye Name: 4-[4-[[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzothiophen-3-yl]methyl]phenoxy]butanenitrile CAS Name: 4-[4-[[2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1-benzothiophen-3-yl]methyl]phenoxy]butanenitrile IUPAC Name: 4-[4-[[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methyl]phenoxy]butanenitrile Traditional Name: 4-[4-[[2-[4-(2-pyrrolidinoethoxy)phenyl]benzothiophen-3-yl]methyl]phenoxy]butyronitrile Formula: C31H32N2O2S MolecularWeight: 496.66298

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)C3=C(C4=CC=CC=C4S3)CC5=CC=C(C=C5)OCCCC#N

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)C3=C(C4=CC=CC=C4S3)CC5=CC=C(C=C5)OCCCC#N

InChI

InChI=1S/C31H32N2O2S/c32-17-3-6-21-34-26-13-9-24(10-14-26)23-29-28-7-1-2-8-30(28)36-31(29)25-11-15-27(16-12-25)35-22-20-33-18-4-5-19-33/h1-2,7-16H,3-6,18-23H2