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

Systemtic Name: (7S)-7-methyl-2-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: (7S)-7-methyl-2-[(E)-2-(4-morpholinophenyl)vinyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one CAS Name: (7S)-7-methyl-2-[(E)-2-[4-(4-morpholinyl)phenyl]ethenyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: (7S)-7-methyl-2-[(E)-2-(4-morpholin-4-ylphenyl)ethenyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: (7S)-7-methyl-2-[(E)-2-(4-morpholinophenyl)vinyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC3=C2C(=O)NC(=N3)C=CC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC3=C2C(=O)NC(=N3)/C=C/C4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C23H25N3O2S/c1-15-2-8-18-19(14-15)29-23-21(18)22(27)24-20(25-23)9-5-16-3-6-17(7-4-16)26-10-12-28-13-11-26/h3-7,9,15H,2,8,10-14H2,1H3,(H,24,25,27)/b9-5+/t15-/m0/s1