2-[1-(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)imino-5-oxidanylidene-imidazol-4-yl]-1-methoxy-ethenolate

Systemtic Name: 2-[1-(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)imino-5-oxidanylidene-imidazol-4-yl]-1-methoxy-ethenolate Openeye Name: 2-[1-(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)imino-5-oxo-imidazol-4-yl]-1-methoxy-ethenolate CAS Name: 2-[1-(4-chlorophenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)imino]-5-oxo-4-imidazolyl]-1-methoxyethenolate IUPAC Name: 2-[1-(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)imino-5-oxoimidazol-4-yl]-1-methoxyethenolate Traditional Name: 2-[1-(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)imino-5-keto-3-imidazolin-4-yl]-1-methoxy-ethenolate Formula: C18H15ClN5O3- MolecularWeight: 384.7964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N=C2N=C(C(=O)N2C3=CC=C(C=C3)Cl)C=C([O-])OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)N=C2N=C(C(=O)N2C3=CC=C(C=C3)Cl)C=C([O-])OC)C

InChI

InChI=1S/C18H16ClN5O3/c1-10-8-11(2)21-17(20-10)23-18-22-14(9-15(25)27-3)16(26)24(18)13-6-4-12(19)5-7-13/h4-9,25H,1-3H3/p-1