3-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[3-(2,5-dimethylphenoxy)-2-oxidanyl-propyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[3-(2,5-dimethylphenoxy)-2-hydroxypropyl]-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[3-(2,5-dimethylphenoxy)-2-hydroxy-propyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C23H22N2O3S MolecularWeight: 406.49738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4)O

InChI

InChI=1S/C23H22N2O3S/c1-15-8-9-16(2)20(10-15)28-13-18(26)12-25-14-24-22-19(23(25)27)11-21(29-22)17-6-4-3-5-7-17/h3-11,14,18,26H,12-13H2,1-2H3