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

Systemtic Name: N-[[3-bromanyl-5-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-methyl-aniline Openeye Name: N-[[3-bromo-5-ethoxy-4-(2-thienylmethoxy)phenyl]methyl]-2-methyl-aniline CAS Name: N-[[3-bromo-5-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-methylaniline IUPAC Name: N-[[3-bromo-5-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]-2-methylaniline Traditional Name: [3-bromo-5-ethoxy-4-(2-thenyloxy)benzyl]-(o-tolyl)amine Formula: C21H22BrNO2S MolecularWeight: 432.37388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNC2=CC=CC=C2C)Br)OCC3=CC=CS3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNC2=CC=CC=C2C)Br)OCC3=CC=CS3

InChI

InChI=1S/C21H22BrNO2S/c1-3-24-20-12-16(13-23-19-9-5-4-7-15(19)2)11-18(22)21(20)25-14-17-8-6-10-26-17/h4-12,23H,3,13-14H2,1-2H3