(4R)-6-oxidanylidene-N-phenyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-4,5-dihydro-1H-pyrimidin-3-ium-4-carboxamide

Systemtic Name: (4R)-6-oxidanylidene-N-phenyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-4,5-dihydro-1H-pyrimidin-3-ium-4-carboxamide Openeye Name: (4R)-6-oxo-N-phenyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-4,5-dihydro-1H-pyrimidin-3-ium-4-carboxamide CAS Name: (4R)-6-oxo-N-phenyl-2-[(4,6,7-trimethyl-2-quinazolinyl)amino]-4,5-dihydro-1H-pyrimidin-3-ium-4-carboxamide IUPAC Name: (4R)-6-oxo-N-phenyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-4,5-dihydro-1H-pyrimidin-3-ium-4-carboxamide Traditional Name: (4R)-6-keto-N-phenyl-2-[(4,6,7-trimethylquinazolin-2-yl)amino]-4,5-dihydro-1H-pyrimidin-3-ium-4-carboxamide Formula: C22H23N6O2+ MolecularWeight: 403.45702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)NC3=[NH+]C(CC(=O)N3)C(=O)NC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)NC3=[NH+][C@H](CC(=O)N3)C(=O)NC4=CC=CC=C4)C)C

InChI

InChI=1S/C22H22N6O2/c1-12-9-16-14(3)23-21(25-17(16)10-13(12)2)28-22-26-18(11-19(29)27-22)20(30)24-15-7-5-4-6-8-15/h4-10,18H,11H2,1-3H3,(H,24,30)(H2,23,25,26,27,28,29)/p+1/t18-/m1/s1