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

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

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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)C5CCCCC5)C

Isomeric SMILES

CC1CCCC(N1C(C)CCCC2=C(C=CC3=C2NC(=O)C(=N3)C4=CC(=CC=C4)C(=N)N)NS(=O)(=O)C5CCCCC5)C

InChI

InChI=1S/C33H46N6O3S/c1-21-10-7-11-22(2)39(21)23(3)12-8-17-27-28(38-43(41,42)26-15-5-4-6-16-26)18-19-29-31(27)37-33(40)30(36-29)24-13-9-14-25(20-24)32(34)35/h9,13-14,18-23,26,38H,4-8,10-12,15-17H2,1-3H3,(H3,34,35)(H,37,40)