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

Systemtic Name: 3-[5-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxidanylidene-4H-quinoxalin-2-yl]piperidine-1-carboximidamide Openeye Name: 3-[5-[4-(2,6-dimethyl-1-piperidyl)pentyl]-3-oxo-4H-quinoxalin-2-yl]piperidine-1-carboxamidine CAS Name: 3-[5-[4-(2,6-dimethyl-1-piperidinyl)pentyl]-3-oxo-4H-quinoxalin-2-yl]-1-piperidinecarboximidamide IUPAC Name: 3-[5-[4-(2,6-dimethylpiperidin-1-yl)pentyl]-3-oxo-4H-quinoxalin-2-yl]piperidine-1-carboximidamide Traditional Name: 3-[5-[4-(2,6-dimethylpiperidino)pentyl]-3-keto-4H-quinoxalin-2-yl]piperidine-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)C4CCCN(C4)C(=N)N)C

Isomeric SMILES

CC1CCCC(N1C(C)CCCC2=C3C(=CC=C2)N=C(C(=O)N3)C4CCCN(C4)C(=N)N)C

InChI

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