N-[[3-bromanyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]-1-thiophen-2-yl-methanamine hydrochloride

Systemtic Name: N-[[3-bromanyl-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]-1-thiophen-2-yl-methanamine hydrochloride Openeye Name: N-[[3-bromo-5-methoxy-4-(3-pyridylmethoxy)phenyl]methyl]-1-(2-thienyl)methanamine hydrochloride CAS Name: N-[[3-bromo-5-methoxy-4-(3-pyridinylmethoxy)phenyl]methyl]-1-thiophen-2-ylmethanamine hydrochloride IUPAC Name: N-[[3-bromo-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]-1-thiophen-2-ylmethanamine hydrochloride Traditional Name: [3-bromo-5-methoxy-4-(3-pyridylmethoxy)benzyl]-(2-thenyl)amine hydrochloride Formula: C19H20BrClN2O2S MolecularWeight: 455.7963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNCC2=CC=CS2)Br)OCC3=CN=CC=C3.Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)CNCC2=CC=CS2)Br)OCC3=CN=CC=C3.Cl

InChI

InChI=1S/C19H19BrN2O2S.ClH/c1-23-18-9-15(11-22-12-16-5-3-7-25-16)8-17(20)19(18)24-13-14-4-2-6-21-10-14;/h2-10,22H,11-13H2,1H3;1H