2-[4-[(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-[(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-[(6-chloro-4-oxo-1H-quinazolin-2-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-[(6-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-1-piperazine-1,4-diiumyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-[(6-chloro-4-oxo-1H-quinazolin-2-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-[(6-chloro-4-keto-1H-quinazolin-2-yl)methyl]piperazine-1,4-diium-1-yl]-N-cyclopropyl-acetamide Formula: C18H24ClN5O2+2 MolecularWeight: 377.86846

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH+]2CC[NH+](CC2)CC3=NC(=O)C4=C(N3)C=CC(=C4)Cl

Isomeric SMILES

C1CC1NC(=O)C[NH+]2CC[NH+](CC2)CC3=NC(=O)C4=C(N3)C=CC(=C4)Cl

InChI

InChI=1S/C18H22ClN5O2/c19-12-1-4-15-14(9-12)18(26)22-16(21-15)10-23-5-7-24(8-6-23)11-17(25)20-13-2-3-13/h1,4,9,13H,2-3,5-8,10-11H2,(H,20,25)(H,21,22,26)/p+2