1-[4-(3-methyl-1-propyl-pyrazol-4-yl)pyrimidin-2-yl]azocane

Systemtic Name: 1-[4-(3-methyl-1-propyl-pyrazol-4-yl)pyrimidin-2-yl]azocane Openeye Name: 1-[4-(3-methyl-1-propyl-pyrazol-4-yl)pyrimidin-2-yl]azocane CAS Name: 1-[4-(3-methyl-1-propyl-4-pyrazolyl)-2-pyrimidinyl]azocane IUPAC Name: 1-[4-(3-methyl-1-propylpyrazol-4-yl)pyrimidin-2-yl]azocane Traditional Name: 1-[4-(3-methyl-1-propyl-pyrazol-4-yl)pyrimidin-2-yl]azocane Formula: C18H27N5 MolecularWeight: 313.44048

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=N1)C)C2=NC(=NC=C2)N3CCCCCCC3

Isomeric SMILES

CCCN1C=C(C(=N1)C)C2=NC(=NC=C2)N3CCCCCCC3

InChI

InChI=1S/C18H27N5/c1-3-11-23-14-16(15(2)21-23)17-9-10-19-18(20-17)22-12-7-5-4-6-8-13-22/h9-10,14H,3-8,11-13H2,1-2H3