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

Systemtic Name: 2-[[cyclopropyl-(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)-cyclopropyl-amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[cyclopropyl-(2-hydroxy-3-phenylmethoxypropyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[cyclopropyl-(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)-cyclopropyl-amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC(COCC3=CC=CC=C3)O)C4CC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC(COCC3=CC=CC=C3)O)C4CC4)C

InChI

InChI=1S/C22H27N3O3S/c1-14-15(2)29-22-20(14)21(27)23-19(24-22)11-25(17-8-9-17)10-18(26)13-28-12-16-6-4-3-5-7-16/h3-7,17-18,26H,8-13H2,1-2H3,(H,23,24,27)