1-cyclopropyl-4-[5-(2-methylpyridin-4-yl)pyridin-2-yl]piperazine hydrate

Systemtic Name: 1-cyclopropyl-4-[5-(2-methylpyridin-4-yl)pyridin-2-yl]piperazine hydrate Openeye Name: 1-cyclopropyl-4-[5-(2-methyl-4-pyridyl)-2-pyridyl]piperazine hydrate CAS Name: 1-cyclopropyl-4-[5-(2-methyl-4-pyridinyl)-2-pyridinyl]piperazine hydrate IUPAC Name: 1-cyclopropyl-4-[5-(2-methylpyridin-4-yl)pyridin-2-yl]piperazine hydrate Traditional Name: 1-cyclopropyl-4-[5-(2-methyl-4-pyridyl)-2-pyridyl]piperazine hydrate Formula: C18H24N4O MolecularWeight: 312.40936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)C2=CN=C(C=C2)N3CCN(CC3)C4CC4.O

Isomeric SMILES

CC1=NC=CC(=C1)C2=CN=C(C=C2)N3CCN(CC3)C4CC4.O

InChI

InChI=1S/C18H22N4.H2O/c1-14-12-15(6-7-19-14)16-2-5-18(20-13-16)22-10-8-21(9-11-22)17-3-4-17;/h2,5-7,12-13,17H,3-4,8-11H2,1H3;1H2