(7S)-3-[(5-ethanoyl-2-ethoxy-phenyl)methyl]-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: (7S)-3-[(5-ethanoyl-2-ethoxy-phenyl)methyl]-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: (7S)-3-[(5-acetyl-2-ethoxy-phenyl)methyl]-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: (7S)-3-[(5-acetyl-2-ethoxyphenyl)methyl]-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: (7S)-3-[(5-acetyl-2-ethoxyphenyl)methyl]-7-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: (7S)-3-(5-acetyl-2-ethoxy-benzyl)-7-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CN2C=NC3=C(C2=O)C4=C(S3)CC(CC4)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CN2C=NC3=C(C2=O)C4=C(S3)C[C@H](CC4)C

InChI

InChI=1S/C22H24N2O3S/c1-4-27-18-8-6-15(14(3)25)10-16(18)11-24-12-23-21-20(22(24)26)17-7-5-13(2)9-19(17)28-21/h6,8,10,12-13H,4-5,7,9,11H2,1-3H3/t13-/m0/s1