N-propan-2-yl-2-(4-quinazolin-4-yl-1,4-diazepan-1-ium-1-yl)ethanamide

Systemtic Name: N-propan-2-yl-2-(4-quinazolin-4-yl-1,4-diazepan-1-ium-1-yl)ethanamide Openeye Name: N-isopropyl-2-(4-quinazolin-4-yl-1,4-diazepan-1-ium-1-yl)acetamide CAS Name: N-propan-2-yl-2-[4-(4-quinazolinyl)-1,4-diazepan-1-ium-1-yl]acetamide IUPAC Name: N-propan-2-yl-2-(4-quinazolin-4-yl-1,4-diazepan-1-ium-1-yl)acetamide Traditional Name: N-isopropyl-2-(4-quinazolin-4-yl-1,4-diazepan-1-ium-1-yl)acetamide Formula: C18H26N5O+ MolecularWeight: 328.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+]1CCCN(CC1)C2=NC=NC3=CC=CC=C32

Isomeric SMILES

CC(C)NC(=O)C[NH+]1CCCN(CC1)C2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C18H25N5O/c1-14(2)21-17(24)12-22-8-5-9-23(11-10-22)18-15-6-3-4-7-16(15)19-13-20-18/h3-4,6-7,13-14H,5,8-12H2,1-2H3,(H,21,24)/p+1