N-(3-azanylhexan-2-yl)-1-chloranyl-isoquinoline-5-sulfonamide

Systemtic Name: N-(3-azanylhexan-2-yl)-1-chloranyl-isoquinoline-5-sulfonamide Openeye Name: N-(2-amino-1-methyl-pentyl)-1-chloro-isoquinoline-5-sulfonamide CAS Name: N-(3-aminohexan-2-yl)-1-chloro-5-isoquinolinesulfonamide IUPAC Name: N-(3-aminohexan-2-yl)-1-chloroisoquinoline-5-sulfonamide Traditional Name: N-(2-amino-1-methyl-pentyl)-1-chloro-isoquinoline-5-sulfonamide Formula: C15H20ClN3O2S MolecularWeight: 341.8562

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C)NS(=O)(=O)C1=CC=CC2=C1C=CN=C2Cl)N

Isomeric SMILES

CCCC(C(C)NS(=O)(=O)C1=CC=CC2=C1C=CN=C2Cl)N

InChI

InChI=1S/C15H20ClN3O2S/c1-3-5-13(17)10(2)19-22(20,21)14-7-4-6-12-11(14)8-9-18-15(12)16/h4,6-10,13,19H,3,5,17H2,1-2H3