1-[4-(5-methyl-1-propyl-pyrazol-4-yl)pyrimidin-2-yl]azepane

Systemtic Name: 1-[4-(5-methyl-1-propyl-pyrazol-4-yl)pyrimidin-2-yl]azepane Openeye Name: 1-[4-(5-methyl-1-propyl-pyrazol-4-yl)pyrimidin-2-yl]azepane CAS Name: 1-[4-(5-methyl-1-propyl-4-pyrazolyl)-2-pyrimidinyl]azepane IUPAC Name: 1-[4-(5-methyl-1-propylpyrazol-4-yl)pyrimidin-2-yl]azepane Traditional Name: 1-[4-(5-methyl-1-propyl-pyrazol-4-yl)pyrimidin-2-yl]azepane Formula: C17H25N5 MolecularWeight: 299.4139

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C=N1)C2=NC(=NC=C2)N3CCCCCC3)C

Isomeric SMILES

CCCN1C(=C(C=N1)C2=NC(=NC=C2)N3CCCCCC3)C

InChI

InChI=1S/C17H25N5/c1-3-10-22-14(2)15(13-19-22)16-8-9-18-17(20-16)21-11-6-4-5-7-12-21/h8-9,13H,3-7,10-12H2,1-2H3