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

Systemtic Name: 3-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(2S)-3-benzyloxy-2-hydroxy-propyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(2S)-2-hydroxy-3-phenylmethoxypropyl]-6-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(2S)-2-hydroxy-3-phenylmethoxypropyl]-6-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[(2S)-3-benzoxy-2-hydroxy-propyl]-6-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H20N2O3S MolecularWeight: 392.4708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)COC[C@H](CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4)O

InChI

InChI=1S/C22H20N2O3S/c25-18(14-27-13-16-7-3-1-4-8-16)12-24-15-23-21-19(22(24)26)11-20(28-21)17-9-5-2-6-10-17/h1-11,15,18,25H,12-14H2/t18-/m0/s1