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

Systemtic Name: 2-[[cyclopropyl-(2-oxidanyl-3-phenyl-propyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[cyclopropyl-(2-hydroxy-3-phenyl-propyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[cyclopropyl-(2-hydroxy-3-phenylpropyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[cyclopropyl-(2-hydroxy-3-phenylpropyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[cyclopropyl-(2-hydroxy-3-phenyl-propyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC(CC3=CC=CC=C3)O)C4CC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC(CC3=CC=CC=C3)O)C4CC4)C

InChI

InChI=1S/C21H25N3O2S/c1-13-14(2)27-21-19(13)20(26)22-18(23-21)12-24(16-8-9-16)11-17(25)10-15-6-4-3-5-7-15/h3-7,16-17,25H,8-12H2,1-2H3,(H,22,23,26)