2-[[2-(azepan-1-yl)phenyl]amino]-N-(3-tert-butyl-1,2-oxazol-5-yl)ethanamide

Systemtic Name: 2-[[2-(azepan-1-yl)phenyl]amino]-N-(3-tert-butyl-1,2-oxazol-5-yl)ethanamide Openeye Name: 2-[2-(azepan-1-yl)anilino]-N-(3-tert-butylisoxazol-5-yl)acetamide CAS Name: 2-[2-(1-azepanyl)anilino]-N-(3-tert-butyl-5-isoxazolyl)acetamide IUPAC Name: 2-[2-(azepan-1-yl)anilino]-N-(3-tert-butyl-1,2-oxazol-5-yl)acetamide Traditional Name: 2-[2-(azepan-1-yl)anilino]-N-(3-tert-butylisoxazol-5-yl)acetamide Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=C1)NC(=O)CNC2=CC=CC=C2N3CCCCCC3

Isomeric SMILES

CC(C)(C)C1=NOC(=C1)NC(=O)CNC2=CC=CC=C2N3CCCCCC3

InChI

InChI=1S/C21H30N4O2/c1-21(2,3)18-14-20(27-24-18)23-19(26)15-22-16-10-6-7-11-17(16)25-12-8-4-5-9-13-25/h6-7,10-11,14,22H,4-5,8-9,12-13,15H2,1-3H3,(H,23,26)