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

Systemtic Name: 3-[3-(3,5-dimethylphenoxy)-2-oxidanyl-propyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[3-(3,5-dimethylphenoxy)-2-hydroxy-propyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[3-(3,5-dimethylphenoxy)-2-hydroxypropyl]-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[3-(3,5-dimethylphenoxy)-2-hydroxypropyl]-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[3-(3,5-dimethylphenoxy)-2-hydroxy-propyl]-5-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(=CC(=C1)OCC(CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4)O)C

InChI

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