N-(3-fluoranyl-4-methyl-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-[4-(2-pyrimidyl)piperazino]propionamide Formula: C18H22FN5O MolecularWeight: 343.398583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)N2CCN(CC2)C3=NC=CC=N3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)N2CCN(CC2)C3=NC=CC=N3)F

InChI

InChI=1S/C18H22FN5O/c1-13-4-5-15(12-16(13)19)22-17(25)14(2)23-8-10-24(11-9-23)18-20-6-3-7-21-18/h3-7,12,14H,8-11H2,1-2H3,(H,22,25)