3-cyclohexyl-N-[4-[(4-methyl-6-piperidin-1-yl-pyrimidin-1-ium-2-yl)amino]phenyl]propanamide

Systemtic Name: 3-cyclohexyl-N-[4-[(4-methyl-6-piperidin-1-yl-pyrimidin-1-ium-2-yl)amino]phenyl]propanamide Openeye Name: 3-cyclohexyl-N-[4-[[4-methyl-6-(1-piperidyl)pyrimidin-1-ium-2-yl]amino]phenyl]propanamide CAS Name: 3-cyclohexyl-N-[4-[[4-methyl-6-(1-piperidinyl)-2-pyrimidin-1-iumyl]amino]phenyl]propanamide IUPAC Name: 3-cyclohexyl-N-[4-[(4-methyl-6-piperidin-1-ylpyrimidin-1-ium-2-yl)amino]phenyl]propanamide Traditional Name: 3-cyclohexyl-N-[4-[(4-methyl-6-piperidino-pyrimidin-1-ium-2-yl)amino]phenyl]propionamide Formula: C25H36N5O+ MolecularWeight: 422.58624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C(=N1)NC2=CC=C(C=C2)NC(=O)CCC3CCCCC3)N4CCCCC4

Isomeric SMILES

CC1=CC(=[NH+]C(=N1)NC2=CC=C(C=C2)NC(=O)CCC3CCCCC3)N4CCCCC4

InChI

InChI=1S/C25H35N5O/c1-19-18-23(30-16-6-3-7-17-30)29-25(26-19)28-22-13-11-21(12-14-22)27-24(31)15-10-20-8-4-2-5-9-20/h11-14,18,20H,2-10,15-17H2,1H3,(H,27,31)(H,26,28,29)/p+1