(2S)-2-azanyl-N-[4-[(2-tert-butyl-6-methoxy-quinolin-8-yl)amino]pentyl]-3-methyl-butanamide

Systemtic Name: (2S)-2-azanyl-N-[4-[(2-tert-butyl-6-methoxy-quinolin-8-yl)amino]pentyl]-3-methyl-butanamide Openeye Name: (2S)-2-amino-N-[4-[(2-tert-butyl-6-methoxy-8-quinolyl)amino]pentyl]-3-methyl-butanamide CAS Name: (2S)-2-amino-N-[4-[(2-tert-butyl-6-methoxy-8-quinolinyl)amino]pentyl]-3-methylbutanamide IUPAC Name: (2S)-2-amino-N-[4-[(2-tert-butyl-6-methoxyquinolin-8-yl)amino]pentyl]-3-methylbutanamide Traditional Name: (2S)-2-amino-N-[4-[(2-tert-butyl-6-methoxy-8-quinolyl)amino]pentyl]-3-methyl-butyramide Formula: C24H38N4O2 MolecularWeight: 414.58412

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCCC(C)NC1=C2C(=CC(=C1)OC)C=CC(=N2)C(C)(C)C)N

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCCC(C)NC1=C2C(=CC(=C1)OC)C=CC(=N2)C(C)(C)C)N

InChI

InChI=1S/C24H38N4O2/c1-15(2)21(25)23(29)26-12-8-9-16(3)27-19-14-18(30-7)13-17-10-11-20(24(4,5)6)28-22(17)19/h10-11,13-16,21,27H,8-9,12,25H2,1-7H3,(H,26,29)/t16?,21-/m0/s1