N-[4-[(E)-3-oxidanylidene-3-(4-pyrimidin-2-ylpiperazin-1-yl)prop-1-enyl]phenyl]ethanamide

Systemtic Name: N-[4-[(E)-3-oxidanylidene-3-(4-pyrimidin-2-ylpiperazin-1-yl)prop-1-enyl]phenyl]ethanamide Openeye Name: N-[4-[(E)-3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)prop-1-enyl]phenyl]acetamide CAS Name: N-[4-[(E)-3-oxo-3-[4-(2-pyrimidinyl)-1-piperazinyl]prop-1-enyl]phenyl]acetamide IUPAC Name: N-[4-[(E)-3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)prop-1-enyl]phenyl]acetamide Traditional Name: N-[4-[(E)-3-keto-3-[4-(2-pyrimidyl)piperazino]prop-1-enyl]phenyl]acetamide Formula: C19H21N5O2 MolecularWeight: 351.40234

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C19H21N5O2/c1-15(25)22-17-6-3-16(4-7-17)5-8-18(26)23-11-13-24(14-12-23)19-20-9-2-10-21-19/h2-10H,11-14H2,1H3,(H,22,25)/b8-5+