2-(tert-butylamino)-4,4-dimethyl-1-[1-(phenylmethyl)imidazol-4-yl]pentan-3-one

Systemtic Name: 2-(tert-butylamino)-4,4-dimethyl-1-[1-(phenylmethyl)imidazol-4-yl]pentan-3-one Openeye Name: 1-(1-benzylimidazol-4-yl)-2-(tert-butylamino)-4,4-dimethyl-pentan-3-one CAS Name: 2-(tert-butylamino)-4,4-dimethyl-1-[1-(phenylmethyl)-4-imidazolyl]-3-pentanone IUPAC Name: 1-(1-benzylimidazol-4-yl)-2-(tert-butylamino)-4,4-dimethylpentan-3-one Traditional Name: 1-(1-benzylimidazol-4-yl)-2-(tert-butylamino)-4,4-dimethyl-pentan-3-one Formula: C21H31N3O MolecularWeight: 341.49034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(CC1=CN(C=N1)CC2=CC=CC=C2)NC(C)(C)C

Isomeric SMILES

CC(C)(C)C(=O)C(CC1=CN(C=N1)CC2=CC=CC=C2)NC(C)(C)C

InChI

InChI=1S/C21H31N3O/c1-20(2,3)19(25)18(23-21(4,5)6)12-17-14-24(15-22-17)13-16-10-8-7-9-11-16/h7-11,14-15,18,23H,12-13H2,1-6H3