N-[3-[[4-(6-bromanyl-3,4-dihydro-1H-isoquinolin-2-yl)-1,3,5-triazin-2-yl]amino]phenyl]oxolane-3-carboxamide

Systemtic Name: N-[3-[[4-(6-bromanyl-3,4-dihydro-1H-isoquinolin-2-yl)-1,3,5-triazin-2-yl]amino]phenyl]oxolane-3-carboxamide Openeye Name: N-[3-[[4-(6-bromo-3,4-dihydro-1H-isoquinolin-2-yl)-1,3,5-triazin-2-yl]amino]phenyl]tetrahydrofuran-3-carboxamide CAS Name: N-[3-[[4-(6-bromo-3,4-dihydro-1H-isoquinolin-2-yl)-1,3,5-triazin-2-yl]amino]phenyl]-3-oxolanecarboxamide IUPAC Name: N-[3-[[4-(6-bromo-3,4-dihydro-1H-isoquinolin-2-yl)-1,3,5-triazin-2-yl]amino]phenyl]oxolane-3-carboxamide Traditional Name: N-[3-[[4-(6-bromo-3,4-dihydro-1H-isoquinolin-2-yl)-s-triazin-2-yl]amino]phenyl]tetrahydrofuran-3-carboxamide Formula: C23H23BrN6O2 MolecularWeight: 495.37172

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1C(=O)NC2=CC=CC(=C2)NC3=NC=NC(=N3)N4CCC5=C(C4)C=CC(=C5)Br

Isomeric SMILES

C1COCC1C(=O)NC2=CC=CC(=C2)NC3=NC=NC(=N3)N4CCC5=C(C4)C=CC(=C5)Br

InChI

InChI=1S/C23H23BrN6O2/c24-18-5-4-16-12-30(8-6-15(16)10-18)23-26-14-25-22(29-23)28-20-3-1-2-19(11-20)27-21(31)17-7-9-32-13-17/h1-5,10-11,14,17H,6-9,12-13H2,(H,27,31)(H,25,26,28,29)