3-[(4-bromanyl-2,5-dimethoxy-phenyl)methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(4-bromanyl-2,5-dimethoxy-phenyl)methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(4-bromo-2,5-dimethoxy-phenyl)methyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(4-bromo-2,5-dimethoxyphenyl)methyl]-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(4-bromo-2,5-dimethoxyphenyl)methyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-bromo-2,5-dimethoxy-benzyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C17H17BrN2O3S MolecularWeight: 409.29748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC(=C(C=C3OC)Br)OC)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC(=C(C=C3OC)Br)OC)C

InChI

InChI=1S/C17H17BrN2O3S/c1-9-10(2)24-16-15(9)17(21)20(8-19-16)7-11-5-14(23-4)12(18)6-13(11)22-3/h5-6,8H,7H2,1-4H3