3-[[5-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxidanylidene-4H-quinoxalin-2-yl]methyl]pyrrolidine-1-carboximidamide

Systemtic Name: 3-[[5-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxidanylidene-4H-quinoxalin-2-yl]methyl]pyrrolidine-1-carboximidamide Openeye Name: 3-[[5-[4-(2,6-dimethyl-1-piperidyl)pentyl]-3-oxo-4H-quinoxalin-2-yl]methyl]pyrrolidine-1-carboxamidine CAS Name: 3-[[5-[4-(2,6-dimethyl-1-piperidinyl)pentyl]-3-oxo-4H-quinoxalin-2-yl]methyl]-1-pyrrolidinecarboximidamide IUPAC Name: 3-[[5-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxo-4H-quinoxalin-2-yl]methyl]pyrrolidine-1-carboximidamide Traditional Name: 3-[[5-[4-(2,6-dimethylpiperidino)pentyl]-3-keto-4H-quinoxalin-2-yl]methyl]pyrrolidine-1-carboxamidine Formula: C26H40N6O MolecularWeight: 452.6354

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(C)CCCC2=C3C(=CC=C2)N=C(C(=O)N3)CC4CCN(C4)C(=N)N)C

Isomeric SMILES

CC1CCCC(N1C(C)CCCC2=C3C(=CC=C2)N=C(C(=O)N3)CC4CCN(C4)C(=N)N)C

InChI

InChI=1S/C26H40N6O/c1-17-7-4-8-18(2)32(17)19(3)9-5-10-21-11-6-12-22-24(21)30-25(33)23(29-22)15-20-13-14-31(16-20)26(27)28/h6,11-12,17-20H,4-5,7-10,13-16H2,1-3H3,(H3,27,28)(H,30,33)