N-(4-cyano-1-propyl-piperidin-4-yl)-4,4-dimethyl-2-[(1-methyl-2-oxidanylidene-quinazolin-4-yl)amino]pentanamide

Systemtic Name: N-(4-cyano-1-propyl-piperidin-4-yl)-4,4-dimethyl-2-[(1-methyl-2-oxidanylidene-quinazolin-4-yl)amino]pentanamide Openeye Name: N-(4-cyano-1-propyl-4-piperidyl)-4,4-dimethyl-2-[(1-methyl-2-oxo-quinazolin-4-yl)amino]pentanamide CAS Name: N-(4-cyano-1-propyl-4-piperidinyl)-4,4-dimethyl-2-[(1-methyl-2-oxo-4-quinazolinyl)amino]pentanamide IUPAC Name: N-(4-cyano-1-propylpiperidin-4-yl)-4,4-dimethyl-2-[(1-methyl-2-oxoquinazolin-4-yl)amino]pentanamide Traditional Name: N-(4-cyano-1-propyl-4-piperidyl)-2-[(2-keto-1-methyl-quinazolin-4-yl)amino]-4,4-dimethyl-valeramide Formula: C25H36N6O2 MolecularWeight: 452.59234

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)(C#N)NC(=O)C(CC(C)(C)C)NC2=NC(=O)N(C3=CC=CC=C32)C

Isomeric SMILES

CCCN1CCC(CC1)(C#N)NC(=O)C(CC(C)(C)C)NC2=NC(=O)N(C3=CC=CC=C32)C

InChI

InChI=1S/C25H36N6O2/c1-6-13-31-14-11-25(17-26,12-15-31)29-22(32)19(16-24(2,3)4)27-21-18-9-7-8-10-20(18)30(5)23(33)28-21/h7-10,19H,6,11-16H2,1-5H3,(H,29,32)(H,27,28,33)