3-[6-(cyclohexylsulfonylamino)-5-[4-(2,2-dimethylpiperidin-1-yl)pentyl]-3-oxidanylidene-4H-quinoxalin-2-yl]benzenecarboximidamide

Systemtic Name: 3-[6-(cyclohexylsulfonylamino)-5-[4-(2,2-dimethylpiperidin-1-yl)pentyl]-3-oxidanylidene-4H-quinoxalin-2-yl]benzenecarboximidamide Openeye Name: 3-[6-(cyclohexylsulfonylamino)-5-[4-(2,2-dimethyl-1-piperidyl)pentyl]-3-oxo-4H-quinoxalin-2-yl]benzamidine CAS Name: 3-[6-(cyclohexylsulfonylamino)-5-[4-(2,2-dimethyl-1-piperidinyl)pentyl]-3-oxo-4H-quinoxalin-2-yl]benzenecarboximidamide IUPAC Name: 3-[6-(cyclohexylsulfonylamino)-5-[4-(2,2-dimethylpiperidin-1-yl)pentyl]-3-oxo-4H-quinoxalin-2-yl]benzenecarboximidamide Traditional Name: 3-[6-(cyclohexylsulfonylamino)-5-[4-(2,2-dimethylpiperidino)pentyl]-3-keto-4H-quinoxalin-2-yl]benzamidine Formula: C33H46N6O3S MolecularWeight: 606.82174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=C(C=CC2=C1NC(=O)C(=N2)C3=CC(=CC=C3)C(=N)N)NS(=O)(=O)C4CCCCC4)N5CCCCC5(C)C

Isomeric SMILES

CC(CCCC1=C(C=CC2=C1NC(=O)C(=N2)C3=CC(=CC=C3)C(=N)N)NS(=O)(=O)C4CCCCC4)N5CCCCC5(C)C

InChI

InChI=1S/C33H46N6O3S/c1-22(39-20-8-7-19-33(39,2)3)11-9-16-26-27(38-43(41,42)25-14-5-4-6-15-25)17-18-28-30(26)37-32(40)29(36-28)23-12-10-13-24(21-23)31(34)35/h10,12-13,17-18,21-22,25,38H,4-9,11,14-16,19-20H2,1-3H3,(H3,34,35)(H,37,40)