(4-iodophenyl)-[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methanone

Systemtic Name: (4-iodophenyl)-[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methanone Openeye Name: (4-iodophenyl)-[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzothiophen-3-yl]methanone CAS Name: (4-iodophenyl)-[2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1-benzothiophen-3-yl]methanone IUPAC Name: (4-iodophenyl)-[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methanone Traditional Name: (4-iodophenyl)-[2-[4-(2-pyrrolidinoethoxy)phenyl]benzothiophen-3-yl]methanone Formula: C27H24INO2S MolecularWeight: 553.45443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)C3=C(C4=CC=CC=C4S3)C(=O)C5=CC=C(C=C5)I

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)C3=C(C4=CC=CC=C4S3)C(=O)C5=CC=C(C=C5)I

InChI

InChI=1S/C27H24INO2S/c28-21-11-7-19(8-12-21)26(30)25-23-5-1-2-6-24(23)32-27(25)20-9-13-22(14-10-20)31-18-17-29-15-3-4-16-29/h1-2,5-14H,3-4,15-18H2