4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one

Systemtic Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one Openeye Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one CAS Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-2-piperazinone IUPAC Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)piperazin-2-one Traditional Name: 4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)piperazin-2-one Formula: C26H29N5O2 MolecularWeight: 443.54076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C3C(=O)NCCN3CC(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C26H29N5O2/c1-18-24(19(2)31(28-18)22-10-4-3-5-11-22)25-26(33)27-13-15-30(25)17-23(32)29-14-12-20-8-6-7-9-21(20)16-29/h3-11,25H,12-17H2,1-2H3,(H,27,33)