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

Systemtic Name: (4-propoxyphenyl)-[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methanone Openeye Name: (4-propoxyphenyl)-[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzothiophen-3-yl]methanone CAS Name: (4-propoxyphenyl)-[2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1-benzothiophen-3-yl]methanone IUPAC Name: (4-propoxyphenyl)-[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methanone Traditional Name: (4-propoxyphenyl)-[2-[4-(2-pyrrolidinoethoxy)phenyl]benzothiophen-3-yl]methanone Formula: C30H31NO3S MolecularWeight: 485.63704

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)C2=C(SC3=CC=CC=C32)C4=CC=C(C=C4)OCCN5CCCC5

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)C2=C(SC3=CC=CC=C32)C4=CC=C(C=C4)OCCN5CCCC5

InChI

InChI=1S/C30H31NO3S/c1-2-20-33-24-13-9-22(10-14-24)29(32)28-26-7-3-4-8-27(26)35-30(28)23-11-15-25(16-12-23)34-21-19-31-17-5-6-18-31/h3-4,7-16H,2,5-6,17-21H2,1H3