1-[4-[(5-cyclohexyloxy-4-phenylazanyl-pyrimidin-2-yl)amino]phenoxy]-3-(dimethylamino)propan-2-ol

Systemtic Name: 1-[4-[(5-cyclohexyloxy-4-phenylazanyl-pyrimidin-2-yl)amino]phenoxy]-3-(dimethylamino)propan-2-ol Openeye Name: 1-[4-[[4-anilino-5-(cyclohexoxy)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol CAS Name: 1-[4-[(4-anilino-5-cyclohexyloxy-2-pyrimidinyl)amino]phenoxy]-3-(dimethylamino)-2-propanol IUPAC Name: 1-[4-[(4-anilino-5-cyclohexyloxypyrimidin-2-yl)amino]phenoxy]-3-(dimethylamino)propan-2-ol Traditional Name: 1-[4-[[4-anilino-5-(cyclohexoxy)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol Formula: C27H35N5O3 MolecularWeight: 477.5985

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3)OC4CCCCC4)O

Isomeric SMILES

CN(C)CC(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3)OC4CCCCC4)O

InChI

InChI=1S/C27H35N5O3/c1-32(2)18-22(33)19-34-23-15-13-21(14-16-23)30-27-28-17-25(35-24-11-7-4-8-12-24)26(31-27)29-20-9-5-3-6-10-20/h3,5-6,9-10,13-17,22,24,33H,4,7-8,11-12,18-19H2,1-2H3,(H2,28,29,30,31)