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

Systemtic Name: 3-[6-(cyclohexylmethylsulfonylamino)-5-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxidanylidene-4H-quinoxalin-2-yl]benzenecarboximidamide Openeye Name: 3-[6-(cyclohexylmethylsulfonylamino)-5-[4-(2,6-dimethyl-1-piperidyl)pentyl]-3-oxo-4H-quinoxalin-2-yl]benzamidine CAS Name: 3-[6-(cyclohexylmethylsulfonylamino)-5-[4-(2,6-dimethyl-1-piperidinyl)pentyl]-3-oxo-4H-quinoxalin-2-yl]benzenecarboximidamide IUPAC Name: 3-[6-(cyclohexylmethylsulfonylamino)-5-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxo-4H-quinoxalin-2-yl]benzenecarboximidamide Traditional Name: 3-[6-(cyclohexylmethylsulfonylamino)-5-[4-(2,6-dimethylpiperidino)pentyl]-3-keto-4H-quinoxalin-2-yl]benzamidine Formula: C34H48N6O3S MolecularWeight: 620.84832

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(C)CCCC2=C(C=CC3=C2NC(=O)C(=N3)C4=CC(=CC=C4)C(=N)N)NS(=O)(=O)CC5CCCCC5)C

Isomeric SMILES

CC1CCCC(N1C(C)CCCC2=C(C=CC3=C2NC(=O)C(=N3)C4=CC(=CC=C4)C(=N)N)NS(=O)(=O)CC5CCCCC5)C

InChI

InChI=1S/C34H48N6O3S/c1-22-10-7-11-23(2)40(22)24(3)12-8-17-28-29(39-44(42,43)21-25-13-5-4-6-14-25)18-19-30-32(28)38-34(41)31(37-30)26-15-9-16-27(20-26)33(35)36/h9,15-16,18-20,22-25,39H,4-8,10-14,17,21H2,1-3H3,(H3,35,36)(H,38,41)