(E)-3-(1-ethylpyrazol-4-yl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(1-ethylpyrazol-4-yl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(1-ethylpyrazol-4-yl)-1-[4-(3-pyridylmethyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(1-ethyl-4-pyrazolyl)-1-[4-(3-pyridinylmethyl)-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(1-ethylpyrazol-4-yl)-1-[4-(pyridin-3-ylmethyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(1-ethylpyrazol-4-yl)-1-[4-(3-pyridylmethyl)piperazino]prop-2-en-1-one Formula: C18H23N5O MolecularWeight: 325.40812

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C=CC(=O)N2CCN(CC2)CC3=CN=CC=C3

Isomeric SMILES

CCN1C=C(C=N1)/C=C/C(=O)N2CCN(CC2)CC3=CN=CC=C3

InChI

InChI=1S/C18H23N5O/c1-2-23-15-17(13-20-23)5-6-18(24)22-10-8-21(9-11-22)14-16-4-3-7-19-12-16/h3-7,12-13,15H,2,8-11,14H2,1H3/b6-5+