1-(1-chloranylisoquinolin-5-yl)sulfonylpropane-1,3-diamine

Systemtic Name: 1-(1-chloranylisoquinolin-5-yl)sulfonylpropane-1,3-diamine Openeye Name: 1-[(1-chloro-5-isoquinolyl)sulfonyl]propane-1,3-diamine CAS Name: 1-[(1-chloro-5-isoquinolinyl)sulfonyl]propane-1,3-diamine IUPAC Name: 1-(1-chloroisoquinolin-5-yl)sulfonylpropane-1,3-diamine Traditional Name: [3-amino-1-[(1-chloro-5-isoquinolyl)sulfonyl]propyl]amine Formula: C12H14ClN3O2S MolecularWeight: 299.77646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2Cl)C(=C1)S(=O)(=O)C(CCN)N

Isomeric SMILES

C1=CC2=C(C=CN=C2Cl)C(=C1)S(=O)(=O)C(CCN)N

InChI

InChI=1S/C12H14ClN3O2S/c13-12-9-2-1-3-10(8(9)5-7-16-12)19(17,18)11(15)4-6-14/h1-3,5,7,11H,4,6,14-15H2