2-[[cyclohexyl-(2-oxidanyl-3-phenylmethoxy-propyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[cyclohexyl-(2-oxidanyl-3-phenylmethoxy-propyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[(3-benzyloxy-2-hydroxy-propyl)-cyclohexyl-amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[cyclohexyl-(2-hydroxy-3-phenylmethoxypropyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[cyclohexyl-(2-hydroxy-3-phenylmethoxypropyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(3-benzoxy-2-hydroxy-propyl)-cyclohexyl-amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC(COCC3=CC=CC=C3)O)C4CCCCC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC(COCC3=CC=CC=C3)O)C4CCCCC4)C

InChI

InChI=1S/C25H33N3O3S/c1-17-18(2)32-25-23(17)24(30)26-22(27-25)14-28(20-11-7-4-8-12-20)13-21(29)16-31-15-19-9-5-3-6-10-19/h3,5-6,9-10,20-21,29H,4,7-8,11-16H2,1-2H3,(H,26,27,30)