[azanyl-[(3-methylphenyl)amino]methylidene]-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]azanium

Systemtic Name: [azanyl-[(3-methylphenyl)amino]methylidene]-[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]azanium Openeye Name: [amino-(3-methylanilino)methylene]-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)ammonium CAS Name: [amino-(3-methylanilino)methylidene]-[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]ammonium IUPAC Name: [amino-(3-methylanilino)methylidene]-(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)azanium Traditional Name: [amino(m-toluidino)methylene]-(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)ammonium Formula: C20H22N5O+ MolecularWeight: 348.42158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=[NH+]C2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3)N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=[NH+]C2=NC(=O)C(=C(N2)C)CC3=CC=CC=C3)N

InChI

InChI=1S/C20H21N5O/c1-13-7-6-10-16(11-13)23-19(21)25-20-22-14(2)17(18(26)24-20)12-15-8-4-3-5-9-15/h3-11H,12H2,1-2H3,(H4,21,22,23,24,25,26)/p+1