(6Z)-2-methyl-6-[(pyrimidin-4-ylamino)methylidene]cyclohexa-2,4-dien-1-one; oxidanylidenevanadium

Systemtic Name: (6Z)-2-methyl-6-[(pyrimidin-4-ylamino)methylidene]cyclohexa-2,4-dien-1-one; oxidanylidenevanadium Openeye Name: (6Z)-2-methyl-6-[(pyrimidin-4-ylamino)methylene]cyclohexa-2,4-dien-1-one; oxovanadium CAS Name: (6Z)-2-methyl-6-[(4-pyrimidinylamino)methylidene]-1-cyclohexa-2,4-dienone; oxovanadium IUPAC Name: (6Z)-2-methyl-6-[(pyrimidin-4-ylamino)methylidene]cyclohexa-2,4-dien-1-one; oxovanadium Traditional Name: ketovanadium; (6Z)-2-methyl-6-[(4-pyrimidylamino)methylene]cyclohexa-2,4-dien-1-one Formula: C12H11N3O2V MolecularWeight: 280.17614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=CNC2=NC=NC=C2)C1=O.O=[V]

Isomeric SMILES

CC1=CC=C/C(=C/NC2=NC=NC=C2)/C1=O.O=[V]

InChI

InChI=1S/C12H11N3O.O.V/c1-9-3-2-4-10(12(9)16)7-14-11-5-6-13-8-15-11;;/h2-8H,1H3,(H,13,14,15);;/b10-7-;;