3-azanyl-5-[(3E)-3-(1,2-dihydropyrazol-3-ylidene)-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]-1-piperidin-3-yl-pyrazin-2-one

Systemtic Name: 3-azanyl-5-[(3E)-3-(1,2-dihydropyrazol-3-ylidene)-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]-1-piperidin-3-yl-pyrazin-2-one Openeye Name: 3-amino-5-[(3E)-3-(1,2-dihydropyrazol-3-ylidene)-6-oxo-cyclohexa-1,4-dien-1-yl]-1-(3-piperidyl)pyrazin-2-one CAS Name: 3-amino-5-[(3E)-3-(1,2-dihydropyrazol-3-ylidene)-6-oxo-1-cyclohexa-1,4-dienyl]-1-(3-piperidinyl)-2-pyrazinone IUPAC Name: 3-amino-5-[(3E)-3-(1,2-dihydropyrazol-3-ylidene)-6-oxocyclohexa-1,4-dien-1-yl]-1-piperidin-3-ylpyrazin-2-one Traditional Name: 3-amino-5-[(3E)-6-keto-3-(3-pyrazolin-3-ylidene)cyclohexa-1,4-dien-1-yl]-1-(3-piperidyl)pyrazin-2-one Formula: C18H20N6O2 MolecularWeight: 352.3904

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)N2C=C(N=C(C2=O)N)C3=CC(=C4C=CNN4)C=CC3=O

Isomeric SMILES

C1CC(CNC1)N2C=C(N=C(C2=O)N)C3=C/C(=C/4\C=CNN4)/C=CC3=O

InChI

InChI=1S/C18H20N6O2/c19-17-18(26)24(12-2-1-6-20-9-12)10-15(22-17)13-8-11(3-4-16(13)25)14-5-7-21-23-14/h3-5,7-8,10,12,20-21,23H,1-2,6,9H2,(H2,19,22)/b14-11+