(7S)-2-[(E)-2-(2-ethoxyphenyl)ethenyl]-7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: (7S)-2-[(E)-2-(2-ethoxyphenyl)ethenyl]-7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: (7S)-2-[(E)-2-(2-ethoxyphenyl)vinyl]-7-methyl-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: (7S)-2-[(E)-2-(2-ethoxyphenyl)ethenyl]-7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: (7S)-2-[(E)-2-(2-ethoxyphenyl)ethenyl]-7-methyl-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: (7S)-7-methyl-2-[(E)-2-o-phenetylvinyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C=CC2=NC3=C(C4=C(S3)CC(CC4)C)C(=O)N2

Isomeric SMILES

CCOC1=CC=CC=C1/C=C/C2=NC3=C(C4=C(S3)C[C@H](CC4)C)C(=O)N2

InChI

InChI=1S/C21H22N2O2S/c1-3-25-16-7-5-4-6-14(16)9-11-18-22-20(24)19-15-10-8-13(2)12-17(15)26-21(19)23-18/h4-7,9,11,13H,3,8,10,12H2,1-2H3,(H,22,23,24)/b11-9+/t13-/m0/s1