N-[1-[1-(1-azanylisoquinolin-7-yl)-2-methyl-piperidin-3-yl]-1-oxidanylidene-propan-2-yl]-7-methoxy-naphthalene-2-sulfonamide

Systemtic Name: N-[1-[1-(1-azanylisoquinolin-7-yl)-2-methyl-piperidin-3-yl]-1-oxidanylidene-propan-2-yl]-7-methoxy-naphthalene-2-sulfonamide Openeye Name: N-[2-[1-(1-amino-7-isoquinolyl)-2-methyl-3-piperidyl]-1-methyl-2-oxo-ethyl]-7-methoxy-naphthalene-2-sulfonamide CAS Name: N-[1-[1-(1-amino-7-isoquinolinyl)-2-methyl-3-piperidinyl]-1-oxopropan-2-yl]-7-methoxy-2-naphthalenesulfonamide IUPAC Name: N-[1-[1-(1-aminoisoquinolin-7-yl)-2-methylpiperidin-3-yl]-1-oxopropan-2-yl]-7-methoxynaphthalene-2-sulfonamide Traditional Name: N-[2-[1-(1-amino-7-isoquinolyl)-2-methyl-3-piperidyl]-2-keto-1-methyl-ethyl]-7-methoxy-naphthalene-2-sulfonamide Formula: C29H32N4O4S MolecularWeight: 532.65378

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCCN1C2=CC3=C(C=C2)C=CN=C3N)C(=O)C(C)NS(=O)(=O)C4=CC5=C(C=CC(=C5)OC)C=C4

Isomeric SMILES

CC1C(CCCN1C2=CC3=C(C=C2)C=CN=C3N)C(=O)C(C)NS(=O)(=O)C4=CC5=C(C=CC(=C5)OC)C=C4

InChI

InChI=1S/C29H32N4O4S/c1-18(32-38(35,36)25-11-8-20-7-10-24(37-3)15-22(20)16-25)28(34)26-5-4-14-33(19(26)2)23-9-6-21-12-13-31-29(30)27(21)17-23/h6-13,15-19,26,32H,4-5,14H2,1-3H3,(H2,30,31)