N-(4-cyano-1-phenethyl-piperidin-4-yl)-4,4-dimethyl-2-[(2-oxidanylidene-1,3-benzoxazin-4-yl)amino]pentanamide

Systemtic Name: N-(4-cyano-1-phenethyl-piperidin-4-yl)-4,4-dimethyl-2-[(2-oxidanylidene-1,3-benzoxazin-4-yl)amino]pentanamide Openeye Name: N-(4-cyano-1-phenethyl-4-piperidyl)-4,4-dimethyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]pentanamide CAS Name: N-(4-cyano-1-phenethyl-4-piperidinyl)-4,4-dimethyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]pentanamide IUPAC Name: N-(4-cyano-1-phenethylpiperidin-4-yl)-4,4-dimethyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]pentanamide Traditional Name: N-(4-cyano-1-phenethyl-4-piperidyl)-2-[(2-keto-1,3-benzoxazin-4-yl)amino]-4,4-dimethyl-valeramide Formula: C29H35N5O3 MolecularWeight: 501.6199

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C(=O)NC1(CCN(CC1)CCC2=CC=CC=C2)C#N)NC3=NC(=O)OC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)CC(C(=O)NC1(CCN(CC1)CCC2=CC=CC=C2)C#N)NC3=NC(=O)OC4=CC=CC=C43

InChI

InChI=1S/C29H35N5O3/c1-28(2,3)19-23(31-25-22-11-7-8-12-24(22)37-27(36)32-25)26(35)33-29(20-30)14-17-34(18-15-29)16-13-21-9-5-4-6-10-21/h4-12,23H,13-19H2,1-3H3,(H,33,35)(H,31,32,36)