4-[3-[6-(3H-benzimidazol-5-ylsulfonylamino)-3,4-dihydro-2H-quinolin-1-yl]-3-oxidanylidene-propyl]benzenecarboximidamide

Systemtic Name: 4-[3-[6-(3H-benzimidazol-5-ylsulfonylamino)-3,4-dihydro-2H-quinolin-1-yl]-3-oxidanylidene-propyl]benzenecarboximidamide Openeye Name: 4-[3-[6-(3H-benzimidazol-5-ylsulfonylamino)-3,4-dihydro-2H-quinolin-1-yl]-3-oxo-propyl]benzamidine CAS Name: 4-[3-[6-(3H-benzimidazol-5-ylsulfonylamino)-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]benzenecarboximidamide IUPAC Name: 4-[3-[6-(3H-benzimidazol-5-ylsulfonylamino)-3,4-dihydro-2H-quinolin-1-yl]-3-oxopropyl]benzenecarboximidamide Traditional Name: 4-[3-[6-(3H-benzimidazol-5-ylsulfonylamino)-3,4-dihydro-2H-quinolin-1-yl]-3-keto-propyl]benzamidine Formula: C26H26N6O3S MolecularWeight: 502.58804

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC4=C(C=C3)N=CN4)N(C1)C(=O)CCC5=CC=C(C=C5)C(=N)N

Isomeric SMILES

C1CC2=C(C=CC(=C2)NS(=O)(=O)C3=CC4=C(C=C3)N=CN4)N(C1)C(=O)CCC5=CC=C(C=C5)C(=N)N

InChI

InChI=1S/C26H26N6O3S/c27-26(28)18-6-3-17(4-7-18)5-12-25(33)32-13-1-2-19-14-20(8-11-24(19)32)31-36(34,35)21-9-10-22-23(15-21)30-16-29-22/h3-4,6-11,14-16,31H,1-2,5,12-13H2,(H3,27,28)(H,29,30)