2-[[furan-2-ylmethyl(2-oxidanylhex-5-enyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[furan-2-ylmethyl(2-oxidanylhex-5-enyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[2-furylmethyl(2-hydroxyhex-5-enyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-furanylmethyl(2-hydroxyhex-5-enyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[furan-2-ylmethyl(2-hydroxyhex-5-enyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-furfuryl(2-hydroxyhex-5-enyl)amino]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC3=CC=CO3)CC(CCC=C)O)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC3=CC=CO3)CC(CCC=C)O)C

InChI

InChI=1S/C20H25N3O3S/c1-4-5-7-15(24)10-23(11-16-8-6-9-26-16)12-17-21-19(25)18-13(2)14(3)27-20(18)22-17/h4,6,8-9,15,24H,1,5,7,10-12H2,2-3H3,(H,21,22,25)