3-[4-[4-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]-3H-quinoxalin-2-yl]benzenecarboximidamide

Systemtic Name: 3-[4-[4-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]-3H-quinoxalin-2-yl]benzenecarboximidamide Openeye Name: 3-[4-[4-[(2,6-dimethyl-1-piperidyl)methyl]phenyl]-3H-quinoxalin-2-yl]benzamidine CAS Name: 3-[4-[4-[(2,6-dimethyl-1-piperidinyl)methyl]phenyl]-3H-quinoxalin-2-yl]benzenecarboximidamide IUPAC Name: 3-[4-[4-[(2,6-dimethylpiperidin-1-yl)methyl]phenyl]-3H-quinoxalin-2-yl]benzenecarboximidamide Traditional Name: 3-[4-[4-[(2,6-dimethylpiperidino)methyl]phenyl]-3H-quinoxalin-2-yl]benzamidine Formula: C29H33N5 MolecularWeight: 451.60582

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1CC2=CC=C(C=C2)N3CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)C(=N)N)C

Isomeric SMILES

CC1CCCC(N1CC2=CC=C(C=C2)N3CC(=NC4=CC=CC=C43)C5=CC(=CC=C5)C(=N)N)C

InChI

InChI=1S/C29H33N5/c1-20-7-5-8-21(2)33(20)18-22-13-15-25(16-14-22)34-19-27(32-26-11-3-4-12-28(26)34)23-9-6-10-24(17-23)29(30)31/h3-4,6,9-17,20-21H,5,7-8,18-19H2,1-2H3,(H3,30,31)