3-cyclopentyl-1-[2-[[4-[3-(dimethylamino)-2-oxidanyl-propoxy]phenyl]amino]-4-phenylazanyl-pyrimidin-5-yl]propan-1-one

Systemtic Name: 3-cyclopentyl-1-[2-[[4-[3-(dimethylamino)-2-oxidanyl-propoxy]phenyl]amino]-4-phenylazanyl-pyrimidin-5-yl]propan-1-one Openeye Name: 1-[4-anilino-2-[4-[3-(dimethylamino)-2-hydroxy-propoxy]anilino]pyrimidin-5-yl]-3-cyclopentyl-propan-1-one CAS Name: 1-[4-anilino-2-[4-[3-(dimethylamino)-2-hydroxypropoxy]anilino]-5-pyrimidinyl]-3-cyclopentyl-1-propanone IUPAC Name: 1-[4-anilino-2-[4-[3-(dimethylamino)-2-hydroxypropoxy]anilino]pyrimidin-5-yl]-3-cyclopentylpropan-1-one Traditional Name: 1-[4-anilino-2-[4-[3-(dimethylamino)-2-hydroxy-propoxy]anilino]pyrimidin-5-yl]-3-cyclopentyl-propan-1-one Formula: C29H37N5O3 MolecularWeight: 503.63578

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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)C(=O)CCC4CCCC4)O

Isomeric SMILES

CN(C)CC(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3)C(=O)CCC4CCCC4)O

InChI

InChI=1S/C29H37N5O3/c1-34(2)19-24(35)20-37-25-15-13-23(14-16-25)32-29-30-18-26(27(36)17-12-21-8-6-7-9-21)28(33-29)31-22-10-4-3-5-11-22/h3-5,10-11,13-16,18,21,24,35H,6-9,12,17,19-20H2,1-2H3,(H2,30,31,32,33)