5-azanyl-4-[[3-azanyl-5-(dimethylaminomethyl)-1H-pyrazol-4-yl]imino]-2-methyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 5-azanyl-4-[[3-azanyl-5-(dimethylaminomethyl)-1H-pyrazol-4-yl]imino]-2-methyl-cyclohexa-2,5-dien-1-one Openeye Name: 5-amino-4-[[3-amino-5-(dimethylaminomethyl)-1H-pyrazol-4-yl]imino]-2-methyl-cyclohexa-2,5-dien-1-one CAS Name: 5-amino-4-[[3-amino-5-(dimethylaminomethyl)-1H-pyrazol-4-yl]imino]-2-methyl-1-cyclohexa-2,5-dienone IUPAC Name: 5-amino-4-[[3-amino-5-(dimethylaminomethyl)-1H-pyrazol-4-yl]imino]-2-methylcyclohexa-2,5-dien-1-one Traditional Name: 5-amino-4-[[3-amino-5-(dimethylaminomethyl)-1H-pyrazol-4-yl]imino]-2-methyl-cyclohexa-2,5-dien-1-one Formula: C13H18N6O MolecularWeight: 274.32162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C(NN=C2N)CN(C)C)C(=CC1=O)N

Isomeric SMILES

CC1=CC(=NC2=C(NN=C2N)CN(C)C)C(=CC1=O)N

InChI

InChI=1S/C13H18N6O/c1-7-4-9(8(14)5-11(7)20)16-12-10(6-19(2)3)17-18-13(12)15/h4-5H,6,14H2,1-3H3,(H3,15,17,18)