N'-tert-butyl-N-[(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-pyridin-3-yl-ethyl]ethanediamide

Systemtic Name: N'-tert-butyl-N-[(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-pyridin-3-yl-ethyl]ethanediamide Openeye Name: N'-tert-butyl-N-[(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-pyridyl)ethyl]oxamide CAS Name: N'-tert-butyl-N-[(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-pyridinyl)ethyl]oxamide IUPAC Name: N'-tert-butyl-N-[(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-pyridin-3-ylethyl]oxamide Traditional Name: N'-tert-butyl-N-[(2R)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-pyridyl)ethyl]oxamide Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C(=O)NCC(C1=CN=CC=C1)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)(C)NC(=O)C(=O)NC[C@@H](C1=CN=CC=C1)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C22H28N4O2/c1-22(2,3)25-21(28)20(27)24-14-19(17-9-6-11-23-13-17)26-12-10-16-7-4-5-8-18(16)15-26/h4-9,11,13,19H,10,12,14-15H2,1-3H3,(H,24,27)(H,25,28)/t19-/m0/s1