2-[[cyclohexyl(2-oxidanylhex-5-enyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[cyclohexyl(2-oxidanylhex-5-enyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[cyclohexyl(2-hydroxyhex-5-enyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[cyclohexyl(2-hydroxyhex-5-enyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[cyclohexyl(2-hydroxyhex-5-enyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[cyclohexyl(2-hydroxyhex-5-enyl)amino]methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(CN(CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1)C4CCCCC4)O

Isomeric SMILES

C=CCCC(CN(CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1)C4CCCCC4)O

InChI

InChI=1S/C25H31N3O2S/c1-2-3-14-20(29)15-28(19-12-8-5-9-13-19)16-22-26-24(30)23-21(17-31-25(23)27-22)18-10-6-4-7-11-18/h2,4,6-7,10-11,17,19-20,29H,1,3,5,8-9,12-16H2,(H,26,27,30)