2-[(3-methyl-6-oxidanylidene-11H-pyrimido[2,1-b]quinazolin-5-ium-2-yl)amino]-N-(phenylmethyl)benzamide

Systemtic Name: 2-[(3-methyl-6-oxidanylidene-11H-pyrimido[2,1-b]quinazolin-5-ium-2-yl)amino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-[(3-methyl-6-oxo-11H-pyrimido[2,1-b]quinazolin-5-ium-2-yl)amino]benzamide CAS Name: 2-[(3-methyl-6-oxo-11H-pyrimido[2,1-b]quinazolin-5-ium-2-yl)amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[(3-methyl-6-oxo-11H-pyrimido[2,1-b]quinazolin-5-ium-2-yl)amino]benzamide Traditional Name: N-benzyl-2-[(6-keto-3-methyl-11H-pyrimido[2,1-b]quinazolin-5-ium-2-yl)amino]benzamide Formula: C26H22N5O2+ MolecularWeight: 436.48518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+]2=C(NC3=CC=CC=C3C2=O)N=C1NC4=CC=CC=C4C(=O)NCC5=CC=CC=C5

Isomeric SMILES

CC1=C[N+]2=C(NC3=CC=CC=C3C2=O)N=C1NC4=CC=CC=C4C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C26H21N5O2/c1-17-16-31-25(33)20-12-6-8-14-22(20)29-26(31)30-23(17)28-21-13-7-5-11-19(21)24(32)27-15-18-9-3-2-4-10-18/h2-14,16H,15H2,1H3,(H2,27,28,29,30,32,33)/p+1