3-(4-azanyl-3,5-dimethyl-pyrazol-1-yl)azepan-2-one

Systemtic Name: 3-(4-azanyl-3,5-dimethyl-pyrazol-1-yl)azepan-2-one Openeye Name: 3-(4-amino-3,5-dimethyl-pyrazol-1-yl)azepan-2-one CAS Name: 3-(4-amino-3,5-dimethyl-1-pyrazolyl)-2-azepanone IUPAC Name: 3-(4-amino-3,5-dimethylpyrazol-1-yl)azepan-2-one Traditional Name: 3-(4-amino-3,5-dimethyl-pyrazol-1-yl)azepan-2-one Formula: C11H18N4O MolecularWeight: 222.28682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2CCCCNC2=O)C)N

Isomeric SMILES

CC1=C(C(=NN1C2CCCCNC2=O)C)N

InChI

InChI=1S/C11H18N4O/c1-7-10(12)8(2)15(14-7)9-5-3-4-6-13-11(9)16/h9H,3-6,12H2,1-2H3,(H,13,16)