N-[2-[[2-(4-chlorophenyl)-6-piperazin-1-yl-pyrimidin-4-yl]amino]ethyl]ethanamide

Systemtic Name: N-[2-[[2-(4-chlorophenyl)-6-piperazin-1-yl-pyrimidin-4-yl]amino]ethyl]ethanamide Openeye Name: N-[2-[[2-(4-chlorophenyl)-6-piperazin-1-yl-pyrimidin-4-yl]amino]ethyl]acetamide CAS Name: N-[2-[[2-(4-chlorophenyl)-6-(1-piperazinyl)-4-pyrimidinyl]amino]ethyl]acetamide IUPAC Name: N-[2-[[2-(4-chlorophenyl)-6-piperazin-1-ylpyrimidin-4-yl]amino]ethyl]acetamide Traditional Name: N-[2-[[2-(4-chlorophenyl)-6-piperazino-pyrimidin-4-yl]amino]ethyl]acetamide Formula: C18H23ClN6O MolecularWeight: 374.86782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)N2CCNCC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)N2CCNCC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H23ClN6O/c1-13(26)21-6-7-22-16-12-17(25-10-8-20-9-11-25)24-18(23-16)14-2-4-15(19)5-3-14/h2-5,12,20H,6-11H2,1H3,(H,21,26)(H,22,23,24)