N-(cyanomethyl)-5,5-dimethyl-2-[[1-[(1-methylpiperidin-4-yl)methyl]-2-oxidanylidene-quinazolin-4-yl]amino]hexanamide

Systemtic Name: N-(cyanomethyl)-5,5-dimethyl-2-[[1-[(1-methylpiperidin-4-yl)methyl]-2-oxidanylidene-quinazolin-4-yl]amino]hexanamide Openeye Name: N-(cyanomethyl)-5,5-dimethyl-2-[[1-[(1-methyl-4-piperidyl)methyl]-2-oxo-quinazolin-4-yl]amino]hexanamide CAS Name: N-(cyanomethyl)-5,5-dimethyl-2-[[1-[(1-methyl-4-piperidinyl)methyl]-2-oxo-4-quinazolinyl]amino]hexanamide IUPAC Name: N-(cyanomethyl)-5,5-dimethyl-2-[[1-[(1-methylpiperidin-4-yl)methyl]-2-oxoquinazolin-4-yl]amino]hexanamide Traditional Name: N-(cyanomethyl)-2-[[2-keto-1-[(1-methyl-4-piperidyl)methyl]quinazolin-4-yl]amino]-5,5-dimethyl-hexanamide Formula: C25H36N6O2 MolecularWeight: 452.59234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCC(C(=O)NCC#N)NC1=NC(=O)N(C2=CC=CC=C21)CC3CCN(CC3)C

Isomeric SMILES

CC(C)(C)CCC(C(=O)NCC#N)NC1=NC(=O)N(C2=CC=CC=C21)CC3CCN(CC3)C

InChI

InChI=1S/C25H36N6O2/c1-25(2,3)12-9-20(23(32)27-14-13-26)28-22-19-7-5-6-8-21(19)31(24(33)29-22)17-18-10-15-30(4)16-11-18/h5-8,18,20H,9-12,14-17H2,1-4H3,(H,27,32)(H,28,29,33)