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

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]propanamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[4-(2-pyrimidyl)piperazino]propionamide Formula: C18H22ClN5O MolecularWeight: 359.85318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(C)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C(C)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C18H22ClN5O/c1-13-15(19)5-3-6-16(13)22-17(25)14(2)23-9-11-24(12-10-23)18-20-7-4-8-21-18/h3-8,14H,9-12H2,1-2H3,(H,22,25)