4-chloranyl-2-(2-diethylaminoethyl)-5-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]pyridazin-3-one

Systemtic Name: 4-chloranyl-2-(2-diethylaminoethyl)-5-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]pyridazin-3-one Openeye Name: 4-chloro-5-[4-[(E)-cinnamyl]piperazin-1-yl]-2-(2-diethylaminoethyl)pyridazin-3-one CAS Name: 4-chloro-2-(2-diethylaminoethyl)-5-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]-3-pyridazinone IUPAC Name: 4-chloro-2-(2-diethylaminoethyl)-5-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]pyridazin-3-one Traditional Name: 4-chloro-5-[4-[(E)-cinnamyl]piperazino]-2-(2-diethylaminoethyl)pyridazin-3-one Formula: C23H32ClN5O MolecularWeight: 429.98608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN(CC)CCN1C(=O)C(=C(C=N1)N2CCN(CC2)C/C=C/C3=CC=CC=C3)Cl

InChI

InChI=1S/C23H32ClN5O/c1-3-26(4-2)15-18-29-23(30)22(24)21(19-25-29)28-16-13-27(14-17-28)12-8-11-20-9-6-5-7-10-20/h5-11,19H,3-4,12-18H2,1-2H3/b11-8+