4-[[(6Z)-6-(3-piperidin-4-yl-1H-imidazol-2-ylidene)-1H-pyrimidin-2-yl]imino]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[(6Z)-6-(3-piperidin-4-yl-1H-imidazol-2-ylidene)-1H-pyrimidin-2-yl]imino]cyclohexa-2,5-dien-1-one Openeye Name: 4-[[(6Z)-6-[3-(4-piperidyl)-1H-imidazol-2-ylidene]-1H-pyrimidin-2-yl]imino]cyclohexa-2,5-dien-1-one CAS Name: 4-[[(6Z)-6-[3-(4-piperidinyl)-1H-imidazol-2-ylidene]-1H-pyrimidin-2-yl]imino]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[(6Z)-6-(3-piperidin-4-yl-1H-imidazol-2-ylidene)-1H-pyrimidin-2-yl]imino]cyclohexa-2,5-dien-1-one Traditional Name: 4-[[(6Z)-6-[1-(4-piperidyl)-4-imidazolin-2-ylidene]-1H-pyrimidin-2-yl]imino]cyclohexa-2,5-dien-1-one Formula: C18H20N6O MolecularWeight: 336.391

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N2C=CNC2=C3C=CN=C(N3)N=C4C=CC(=O)C=C4

Isomeric SMILES

C1CNCCC1N\2C=CN/C2=C/3\C=CN=C(N3)N=C4C=CC(=O)C=C4

InChI

InChI=1S/C18H20N6O/c25-15-3-1-13(2-4-15)22-18-21-10-7-16(23-18)17-20-11-12-24(17)14-5-8-19-9-6-14/h1-4,7,10-12,14,19-20H,5-6,8-9H2,(H,21,23)/b17-16-