1-(4-cyclobutylpiperazin-1-yl)-2-(6-pyrazol-1-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 1-(4-cyclobutylpiperazin-1-yl)-2-(6-pyrazol-1-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 1-(4-cyclobutylpiperazin-1-yl)-2-(6-pyrazol-1-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone CAS Name: 1-(4-cyclobutyl-1-piperazinyl)-2-[6-(1-pyrazolyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone IUPAC Name: 1-(4-cyclobutylpiperazin-1-yl)-2-(6-pyrazol-1-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 1-(4-cyclobutylpiperazino)-2-(6-pyrazol-1-yl-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Formula: C22H29N5O MolecularWeight: 379.49856

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2CCN(CC2)C(=O)CN3CCC4=C(C3)C=CC(=C4)N5C=CC=N5

Isomeric SMILES

C1CC(C1)N2CCN(CC2)C(=O)CN3CCC4=C(C3)C=CC(=C4)N5C=CC=N5

InChI

InChI=1S/C22H29N5O/c28-22(26-13-11-25(12-14-26)20-3-1-4-20)17-24-10-7-18-15-21(6-5-19(18)16-24)27-9-2-8-23-27/h2,5-6,8-9,15,20H,1,3-4,7,10-14,16-17H2