2-(5-bromanyl-2-phenylmethoxy-phenyl)-5,6-dimethyl-2,3-dihydro-1H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(5-bromanyl-2-phenylmethoxy-phenyl)-5,6-dimethyl-2,3-dihydro-1H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(2-benzyloxy-5-bromo-phenyl)-5,6-dimethyl-2,3-dihydro-1H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(5-bromo-2-phenylmethoxyphenyl)-5,6-dimethyl-2,3-dihydro-1H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(5-bromo-2-phenylmethoxyphenyl)-5,6-dimethyl-2,3-dihydro-1H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(2-benzoxy-5-bromo-phenyl)-5,6-dimethyl-2,3-dihydro-1H-thieno[2,3-d]pyrimidin-4-one Formula: C21H19BrN2O2S MolecularWeight: 443.35676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(N2)C3=C(C=CC(=C3)Br)OCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(N2)C3=C(C=CC(=C3)Br)OCC4=CC=CC=C4)C

InChI

InChI=1S/C21H19BrN2O2S/c1-12-13(2)27-21-18(12)20(25)23-19(24-21)16-10-15(22)8-9-17(16)26-11-14-6-4-3-5-7-14/h3-10,19,24H,11H2,1-2H3,(H,23,25)