3-[4-[(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-6-morpholin-4-yl-pyrimidin-2-yl]phenol

Systemtic Name: 3-[4-[(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-6-morpholin-4-yl-pyrimidin-2-yl]phenol Openeye Name: 3-[4-[(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-6-morpholino-pyrimidin-2-yl]phenol CAS Name: 3-[4-[(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-6-(4-morpholinyl)-2-pyrimidinyl]phenol IUPAC Name: 3-[4-[(2-methylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-6-morpholin-4-ylpyrimidin-2-yl]phenol Traditional Name: 3-[4-[(2-mesyl-3,4-dihydro-1H-isoquinolin-7-yl)amino]-6-morpholino-pyrimidin-2-yl]phenol Formula: C24H27N5O4S MolecularWeight: 481.56728

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC3=NC(=NC(=C3)N4CCOCC4)C5=CC(=CC=C5)O

Isomeric SMILES

CS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC3=NC(=NC(=C3)N4CCOCC4)C5=CC(=CC=C5)O

InChI

InChI=1S/C24H27N5O4S/c1-34(31,32)29-8-7-17-5-6-20(13-19(17)16-29)25-22-15-23(28-9-11-33-12-10-28)27-24(26-22)18-3-2-4-21(30)14-18/h2-6,13-15,30H,7-12,16H2,1H3,(H,25,26,27)