1-[(2-azanyl-6-chloranyl-pyrimidin-4-yl)amino]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol

Systemtic Name: 1-[(2-azanyl-6-chloranyl-pyrimidin-4-yl)amino]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol Openeye Name: 1-[(2-amino-6-chloro-pyrimidin-4-yl)amino]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol CAS Name: 1-[(2-amino-6-chloro-4-pyrimidinyl)amino]-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-propanol IUPAC Name: 1-[(2-amino-6-chloropyrimidin-4-yl)amino]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol Traditional Name: 1-[(2-amino-6-chloro-pyrimidin-4-yl)amino]-3-(3,4-dihydro-1H-isoquinolin-2-yl)propan-2-ol Formula: C16H20ClN5O MolecularWeight: 333.8159

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC(CNC3=CC(=NC(=N3)N)Cl)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC(CNC3=CC(=NC(=N3)N)Cl)O

InChI

InChI=1S/C16H20ClN5O/c17-14-7-15(21-16(18)20-14)19-8-13(23)10-22-6-5-11-3-1-2-4-12(11)9-22/h1-4,7,13,23H,5-6,8-10H2,(H3,18,19,20,21)