2,3-dimethoxy-5-methyl-6-[(3-thiomorpholin-4-ylcarbonylphenyl)methyl]cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,3-dimethoxy-5-methyl-6-[(3-thiomorpholin-4-ylcarbonylphenyl)methyl]cyclohexa-2,5-diene-1,4-dione Openeye Name: 2,3-dimethoxy-5-methyl-6-[[3-(thiomorpholine-4-carbonyl)phenyl]methyl]-1,4-benzoquinone CAS Name: 2,3-dimethoxy-5-methyl-6-[[3-[oxo(thiomorpholin-4-yl)methyl]phenyl]methyl]cyclohexa-2,5-diene-1,4-dione IUPAC Name: 2,3-dimethoxy-5-methyl-6-[[3-(thiomorpholine-4-carbonyl)phenyl]methyl]cyclohexa-2,5-diene-1,4-dione Traditional Name: 2,3-dimethoxy-5-methyl-6-[3-(thiomorpholine-4-carbonyl)benzyl]-p-benzoquinone Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)OC)OC)CC2=CC=CC(=C2)C(=O)N3CCSCC3

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)OC)OC)CC2=CC=CC(=C2)C(=O)N3CCSCC3

InChI

InChI=1S/C21H23NO5S/c1-13-16(18(24)20(27-3)19(26-2)17(13)23)12-14-5-4-6-15(11-14)21(25)22-7-9-28-10-8-22/h4-6,11H,7-10,12H2,1-3H3