N-tert-butyl-2-[4-(2-pyridin-3-ylquinazolin-4-yl)-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-(2-pyridin-3-ylquinazolin-4-yl)-1,4-diazepan-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-(3-pyridyl)quinazolin-4-yl]-1,4-diazepan-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[2-(3-pyridinyl)-4-quinazolinyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-tert-butyl-2-[4-(2-pyridin-3-ylquinazolin-4-yl)-1,4-diazepan-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-(3-pyridyl)quinazolin-4-yl]-1,4-diazepan-1-yl]acetamide Formula: C24H30N6O MolecularWeight: 418.5346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCCN(CC1)C2=NC(=NC3=CC=CC=C32)C4=CN=CC=C4

InChI

InChI=1S/C24H30N6O/c1-24(2,3)28-21(31)17-29-12-7-13-30(15-14-29)23-19-9-4-5-10-20(19)26-22(27-23)18-8-6-11-25-16-18/h4-6,8-11,16H,7,12-15,17H2,1-3H3,(H,28,31)