3-methyl-1-[4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazin-1-yl]but-2-en-1-one

Systemtic Name: 3-methyl-1-[4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazin-1-yl]but-2-en-1-one Openeye Name: 3-methyl-1-[4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazin-1-yl]but-2-en-1-one CAS Name: 3-methyl-1-[4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]-1-piperazinyl]-2-buten-1-one IUPAC Name: 3-methyl-1-[4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazin-1-yl]but-2-en-1-one Traditional Name: 3-methyl-1-[4-[2-[4-(1H-pyrazol-5-yl)phenoxy]ethyl]piperazino]but-2-en-1-one Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCN(CC1)CCOC2=CC=C(C=C2)C3=CC=NN3)C

Isomeric SMILES

CC(=CC(=O)N1CCN(CC1)CCOC2=CC=C(C=C2)C3=CC=NN3)C

InChI

InChI=1S/C20H26N4O2/c1-16(2)15-20(25)24-11-9-23(10-12-24)13-14-26-18-5-3-17(4-6-18)19-7-8-21-22-19/h3-8,15H,9-14H2,1-2H3,(H,21,22)