N-(3-azanylbutan-2-yl)-N-butyl-isoquinoline-5-sulfonamide

Systemtic Name: N-(3-azanylbutan-2-yl)-N-butyl-isoquinoline-5-sulfonamide Openeye Name: N-(2-amino-1-methyl-propyl)-N-butyl-isoquinoline-5-sulfonamide CAS Name: N-(3-aminobutan-2-yl)-N-butyl-5-isoquinolinesulfonamide IUPAC Name: N-(3-aminobutan-2-yl)-N-butylisoquinoline-5-sulfonamide Traditional Name: N-(2-amino-1-methyl-propyl)-N-butyl-isoquinoline-5-sulfonamide Formula: C17H25N3O2S MolecularWeight: 335.4643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C)C(C)N)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCCCN(C(C)C(C)N)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C17H25N3O2S/c1-4-5-11-20(14(3)13(2)18)23(21,22)17-8-6-7-15-12-19-10-9-16(15)17/h6-10,12-14H,4-5,11,18H2,1-3H3