5,6-dimethyl-2-[(2S)-3-(3-methylphenoxy)-2-oxidanyl-propyl]sulfanyl-3-propan-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5,6-dimethyl-2-[(2S)-3-(3-methylphenoxy)-2-oxidanyl-propyl]sulfanyl-3-propan-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]sulfanyl-3-isopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]thio]-5,6-dimethyl-3-propan-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]sulfanyl-5,6-dimethyl-3-propan-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]thio]-3-isopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2C(C)C)O

Isomeric SMILES

CC1=CC(=CC=C1)OC[C@@H](CSC2=NC3=C(C(=C(S3)C)C)C(=O)N2C(C)C)O

InChI

InChI=1S/C21H26N2O3S2/c1-12(2)23-20(25)18-14(4)15(5)28-19(18)22-21(23)27-11-16(24)10-26-17-8-6-7-13(3)9-17/h6-9,12,16,24H,10-11H2,1-5H3/t16-/m0/s1