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

Systemtic Name: 3-[3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]aniline Openeye Name: 3-[3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]benzothiophen-2-yl]aniline CAS Name: 3-[3-[[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]aniline IUPAC Name: 3-[3-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]methyl]-1-benzothiophen-2-yl]aniline Traditional Name: [3-[3-[4-(2-pyrrolidinoethoxy)benzyl]benzothiophen-2-yl]phenyl]amine Formula: C27H28N2OS MolecularWeight: 428.58902

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)CC3=C(SC4=CC=CC=C43)C5=CC(=CC=C5)N

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)CC3=C(SC4=CC=CC=C43)C5=CC(=CC=C5)N

InChI

InChI=1S/C27H28N2OS/c28-22-7-5-6-21(19-22)27-25(24-8-1-2-9-26(24)31-27)18-20-10-12-23(13-11-20)30-17-16-29-14-3-4-15-29/h1-2,5-13,19H,3-4,14-18,28H2