2-tert-butyl-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one

Systemtic Name: 2-tert-butyl-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one Openeye Name: 2-tert-butyl-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one CAS Name: 2-tert-butyl-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one IUPAC Name: 2-tert-butyl-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one Traditional Name: 2-tert-butyl-5,7-dihydropyrimido[5,4-d][1]benzazepin-6-one Formula: C16H17N3O MolecularWeight: 267.32568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC=C2CC(=O)NC3=CC=CC=C3C2=N1

Isomeric SMILES

CC(C)(C)C1=NC=C2CC(=O)NC3=CC=CC=C3C2=N1

InChI

InChI=1S/C16H17N3O/c1-16(2,3)15-17-9-10-8-13(20)18-12-7-5-4-6-11(12)14(10)19-15/h4-7,9H,8H2,1-3H3,(H,18,20)