[azanyl-[(3-chloranyl-2-methyl-phenyl)amino]methylidene]-(4-oxidanylidene-6-pyridin-4-yl-1H-pyrimidin-2-yl)azanium

Systemtic Name: [azanyl-[(3-chloranyl-2-methyl-phenyl)amino]methylidene]-(4-oxidanylidene-6-pyridin-4-yl-1H-pyrimidin-2-yl)azanium Openeye Name: [amino-(3-chloro-2-methyl-anilino)methylene]-[4-oxo-6-(4-pyridyl)-1H-pyrimidin-2-yl]ammonium CAS Name: [amino-(3-chloro-2-methylanilino)methylidene]-(4-oxo-6-pyridin-4-yl-1H-pyrimidin-2-yl)ammonium IUPAC Name: [amino-(3-chloro-2-methylanilino)methylidene]-(4-oxo-6-pyridin-4-yl-1H-pyrimidin-2-yl)azanium Traditional Name: [amino-(3-chloro-2-methyl-anilino)methylene]-[4-keto-6-(4-pyridyl)-1H-pyrimidin-2-yl]ammonium Formula: C17H16ClN6O+ MolecularWeight: 355.80154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=[NH+]C2=NC(=O)C=C(N2)C3=CC=NC=C3)N

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=[NH+]C2=NC(=O)C=C(N2)C3=CC=NC=C3)N

InChI

InChI=1S/C17H15ClN6O/c1-10-12(18)3-2-4-13(10)21-16(19)24-17-22-14(9-15(25)23-17)11-5-7-20-8-6-11/h2-9H,1H3,(H4,19,21,22,23,24,25)/p+1