[2-(3-methylpiperazin-1-yl)pyridin-3-yl]-(3,3,5-trimethylazepan-1-yl)methanone

Systemtic Name: [2-(3-methylpiperazin-1-yl)pyridin-3-yl]-(3,3,5-trimethylazepan-1-yl)methanone Openeye Name: [2-(3-methylpiperazin-1-yl)-3-pyridyl]-(3,3,5-trimethylazepan-1-yl)methanone CAS Name: [2-(3-methyl-1-piperazinyl)-3-pyridinyl]-(3,3,5-trimethyl-1-azepanyl)methanone IUPAC Name: [2-(3-methylpiperazin-1-yl)pyridin-3-yl]-(3,3,5-trimethylazepan-1-yl)methanone Traditional Name: [2-(3-methylpiperazino)-3-pyridyl]-(3,3,5-trimethylazepan-1-yl)methanone Formula: C20H32N4O MolecularWeight: 344.49428

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC(C1)(C)C)C(=O)C2=C(N=CC=C2)N3CCNC(C3)C

Isomeric SMILES

CC1CCN(CC(C1)(C)C)C(=O)C2=C(N=CC=C2)N3CCNC(C3)C

InChI

InChI=1S/C20H32N4O/c1-15-7-10-24(14-20(3,4)12-15)19(25)17-6-5-8-22-18(17)23-11-9-21-16(2)13-23/h5-6,8,15-16,21H,7,9-14H2,1-4H3