N-[2-(azepan-1-yl)propyl]-3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanamide

Systemtic Name: N-[2-(azepan-1-yl)propyl]-3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanamide Openeye Name: N-[2-(azepan-1-yl)propyl]-3-(6-bromo-4-oxo-quinazolin-3-yl)propanamide CAS Name: N-[2-(1-azepanyl)propyl]-3-(6-bromo-4-oxo-3-quinazolinyl)propanamide IUPAC Name: N-[2-(azepan-1-yl)propyl]-3-(6-bromo-4-oxoquinazolin-3-yl)propanamide Traditional Name: N-[2-(azepan-1-yl)propyl]-3-(6-bromo-4-keto-quinazolin-3-yl)propionamide Formula: C20H27BrN4O2 MolecularWeight: 435.35798

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)CCN1C=NC2=C(C1=O)C=C(C=C2)Br)N3CCCCCC3

Isomeric SMILES

CC(CNC(=O)CCN1C=NC2=C(C1=O)C=C(C=C2)Br)N3CCCCCC3

InChI

InChI=1S/C20H27BrN4O2/c1-15(24-9-4-2-3-5-10-24)13-22-19(26)8-11-25-14-23-18-7-6-16(21)12-17(18)20(25)27/h6-7,12,14-15H,2-5,8-11,13H2,1H3,(H,22,26)