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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CCCCCN2C3=C(C=CC(=C3)NS(=O)(=O)C4CCCCC4)N=C(C2=O)C5=CC(=CC=C5)C(=N)N)C

Isomeric SMILES

CC1CCCC(N1CCCCCN2C3=C(C=CC(=C3)NS(=O)(=O)C4CCCCC4)N=C(C2=O)C5=CC(=CC=C5)C(=N)N)C

InChI

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