N-[[3-bromanyl-5-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-4-pyrrolidin-1-yl-aniline

Systemtic Name: N-[[3-bromanyl-5-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-4-pyrrolidin-1-yl-aniline Openeye Name: N-[[3-bromo-5-ethoxy-4-(2-thienylmethoxy)phenyl]methyl]-4-pyrrolidin-1-yl-aniline CAS Name: N-[[3-bromo-5-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-4-(1-pyrrolidinyl)aniline IUPAC Name: N-[[3-bromo-5-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-4-pyrrolidin-1-ylaniline Traditional Name: [3-bromo-5-ethoxy-4-(2-thenyloxy)benzyl]-(4-pyrrolidinophenyl)amine Formula: C24H27BrN2O2S MolecularWeight: 487.45238

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNC2=CC=C(C=C2)N3CCCC3)Br)OCC4=CC=CS4

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNC2=CC=C(C=C2)N3CCCC3)Br)OCC4=CC=CS4

InChI

InChI=1S/C24H27BrN2O2S/c1-2-28-23-15-18(14-22(25)24(23)29-17-21-6-5-13-30-21)16-26-19-7-9-20(10-8-19)27-11-3-4-12-27/h5-10,13-15,26H,2-4,11-12,16-17H2,1H3