5-[[5-methoxy-1-(phenylsulfonyl)indol-3-yl]methyl]-1,3-dimethyl-6-oxidanyl-pyrimidine-2,4-dione

Systemtic Name: 5-[[5-methoxy-1-(phenylsulfonyl)indol-3-yl]methyl]-1,3-dimethyl-6-oxidanyl-pyrimidine-2,4-dione Openeye Name: 5-[[1-(benzenesulfonyl)-5-methoxy-indol-3-yl]methyl]-6-hydroxy-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 5-[[1-(benzenesulfonyl)-5-methoxy-3-indolyl]methyl]-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 5-[[1-(benzenesulfonyl)-5-methoxyindol-3-yl]methyl]-6-hydroxy-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 5-[(1-besyl-5-methoxy-indol-3-yl)methyl]-6-hydroxy-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C22H21N3O6S MolecularWeight: 455.48364

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)CC2=CN(C3=C2C=C(C=C3)OC)S(=O)(=O)C4=CC=CC=C4)O

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)CC2=CN(C3=C2C=C(C=C3)OC)S(=O)(=O)C4=CC=CC=C4)O

InChI

InChI=1S/C22H21N3O6S/c1-23-20(26)18(21(27)24(2)22(23)28)11-14-13-25(19-10-9-15(31-3)12-17(14)19)32(29,30)16-7-5-4-6-8-16/h4-10,12-13,26H,11H2,1-3H3