1-(5-isoquinolin-5-ylthiophen-2-yl)butan-1-amine

Systemtic Name: 1-(5-isoquinolin-5-ylthiophen-2-yl)butan-1-amine Openeye Name: 1-[5-(5-isoquinolyl)-2-thienyl]butan-1-amine CAS Name: 1-[5-(5-isoquinolinyl)-2-thiophenyl]-1-butanamine IUPAC Name: 1-(5-isoquinolin-5-ylthiophen-2-yl)butan-1-amine Traditional Name: 1-[5-(5-isoquinolyl)-2-thienyl]butylamine Formula: C17H18N2S MolecularWeight: 282.40322

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(S1)C2=CC=CC3=C2C=CN=C3)N

Isomeric SMILES

CCCC(C1=CC=C(S1)C2=CC=CC3=C2C=CN=C3)N

InChI

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