N-[(5-isoquinolin-5-ylthiophen-2-yl)methyl]propan-1-amine

Systemtic Name: N-[(5-isoquinolin-5-ylthiophen-2-yl)methyl]propan-1-amine Openeye Name: N-[[5-(5-isoquinolyl)-2-thienyl]methyl]propan-1-amine CAS Name: N-[[5-(5-isoquinolinyl)-2-thiophenyl]methyl]-1-propanamine IUPAC Name: N-[(5-isoquinolin-5-ylthiophen-2-yl)methyl]propan-1-amine Traditional Name: [5-(5-isoquinolyl)-2-thienyl]methyl-propyl-amine Formula: C17H18N2S MolecularWeight: 282.40322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CC=C(S1)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCCNCC1=CC=C(S1)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C17H18N2S/c1-2-9-18-12-14-6-7-17(20-14)16-5-3-4-13-11-19-10-8-15(13)16/h3-8,10-11,18H,2,9,12H2,1H3