4-[5-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]pyridin-2-yl]-2,6-dimethyl-morpholine

Systemtic Name: 4-[5-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]pyridin-2-yl]-2,6-dimethyl-morpholine Openeye Name: 4-[5-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-2-pyridyl]-2,6-dimethyl-morpholine CAS Name: 4-[5-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-2-pyridinyl]-2,6-dimethylmorpholine IUPAC Name: 4-[5-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]pyridin-2-yl]-2,6-dimethylmorpholine Traditional Name: 4-[5-[1-(4-ethylpiperazino)-3-isoquinolyl]-2-pyridyl]-2,6-dimethyl-morpholine Formula: C26H33N5O MolecularWeight: 431.57312

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CN=C(C=C4)N5CC(OC(C5)C)C

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CN=C(C=C4)N5CC(OC(C5)C)C

InChI

InChI=1S/C26H33N5O/c1-4-29-11-13-30(14-12-29)26-23-8-6-5-7-21(23)15-24(28-26)22-9-10-25(27-16-22)31-17-19(2)32-20(3)18-31/h5-10,15-16,19-20H,4,11-14,17-18H2,1-3H3