[4-methyl-3-[[2-[(3-methylsulfonyl-5-morpholin-4-yl-phenyl)amino]pyrimidin-4-yl]-propan-2-yl-amino]phenyl]methanol

Systemtic Name: [4-methyl-3-[[2-[(3-methylsulfonyl-5-morpholin-4-yl-phenyl)amino]pyrimidin-4-yl]-propan-2-yl-amino]phenyl]methanol Openeye Name: [3-[isopropyl-[2-(3-methylsulfonyl-5-morpholino-anilino)pyrimidin-4-yl]amino]-4-methyl-phenyl]methanol CAS Name: [4-methyl-3-[[2-[3-methylsulfonyl-5-(4-morpholinyl)anilino]-4-pyrimidinyl]-propan-2-ylamino]phenyl]methanol IUPAC Name: [4-methyl-3-[[2-(3-methylsulfonyl-5-morpholin-4-ylanilino)pyrimidin-4-yl]-propan-2-ylamino]phenyl]methanol Traditional Name: [3-[isopropyl-[2-(3-mesyl-5-morpholino-anilino)pyrimidin-4-yl]amino]-4-methyl-phenyl]methanol Formula: C26H33N5O4S MolecularWeight: 511.63632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CO)N(C2=NC(=NC=C2)NC3=CC(=CC(=C3)N4CCOCC4)S(=O)(=O)C)C(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)CO)N(C2=NC(=NC=C2)NC3=CC(=CC(=C3)N4CCOCC4)S(=O)(=O)C)C(C)C

InChI

InChI=1S/C26H33N5O4S/c1-18(2)31(24-13-20(17-32)6-5-19(24)3)25-7-8-27-26(29-25)28-21-14-22(30-9-11-35-12-10-30)16-23(15-21)36(4,33)34/h5-8,13-16,18,32H,9-12,17H2,1-4H3,(H,27,28,29)