[5-(azepan-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methanamine

Systemtic Name: [5-(azepan-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methanamine Openeye Name: [5-(azepan-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methanamine CAS Name: [5-(1-azepanyl)-3-methyl-1-phenyl-4-pyrazolyl]methanamine IUPAC Name: [5-(azepan-1-yl)-3-methyl-1-phenylpyrazol-4-yl]methanamine Traditional Name: [5-(azepan-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methylamine Formula: C17H24N4 MolecularWeight: 284.39926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN)N2CCCCCC2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1CN)N2CCCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C17H24N4/c1-14-16(13-18)17(20-11-7-2-3-8-12-20)21(19-14)15-9-5-4-6-10-15/h4-6,9-10H,2-3,7-8,11-13,18H2,1H3