N-tert-butyl-2-(5-cyclohexyl-2-oxidanylidene-3H-1,3,4-benzotriazepin-1-yl)ethanamide

Systemtic Name: N-tert-butyl-2-(5-cyclohexyl-2-oxidanylidene-3H-1,3,4-benzotriazepin-1-yl)ethanamide Openeye Name: N-tert-butyl-2-(5-cyclohexyl-2-oxo-3H-1,3,4-benzotriazepin-1-yl)acetamide CAS Name: N-tert-butyl-2-(5-cyclohexyl-2-oxo-3H-1,3,4-benzotriazepin-1-yl)acetamide IUPAC Name: N-tert-butyl-2-(5-cyclohexyl-2-oxo-3H-1,3,4-benzotriazepin-1-yl)acetamide Traditional Name: N-tert-butyl-2-(5-cyclohexyl-2-keto-3H-1,3,4-benzotriazepin-1-yl)acetamide Formula: C20H28N4O2 MolecularWeight: 356.46192

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1C2=CC=CC=C2C(=NNC1=O)C3CCCCC3

Isomeric SMILES

CC(C)(C)NC(=O)CN1C2=CC=CC=C2C(=NNC1=O)C3CCCCC3

InChI

InChI=1S/C20H28N4O2/c1-20(2,3)21-17(25)13-24-16-12-8-7-11-15(16)18(22-23-19(24)26)14-9-5-4-6-10-14/h7-8,11-12,14H,4-6,9-10,13H2,1-3H3,(H,21,25)(H,23,26)