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

Systemtic Name: 3-[(5-bromanyl-2-methoxy-phenyl)methyl]-2-(diethylaminomethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[(5-bromo-2-methoxy-phenyl)methyl]-2-(diethylaminomethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[(5-bromo-2-methoxyphenyl)methyl]-2-(diethylaminomethyl)-5,6-dimethyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[(5-bromo-2-methoxyphenyl)methyl]-2-(diethylaminomethyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(5-bromo-2-methoxy-benzyl)-2-(diethylaminomethyl)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H26BrN3O2S MolecularWeight: 464.41904

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=NC2=C(C(=C(S2)C)C)C(=O)N1CC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CCN(CC)CC1=NC2=C(C(=C(S2)C)C)C(=O)N1CC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C21H26BrN3O2S/c1-6-24(7-2)12-18-23-20-19(13(3)14(4)28-20)21(26)25(18)11-15-10-16(22)8-9-17(15)27-5/h8-10H,6-7,11-12H2,1-5H3