5-(4-bromophenyl)-2-[(2-methoxyphenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-bromophenyl)-2-[(2-methoxyphenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-2-[(2-methoxyphenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-2-[(2-methoxyphenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-bromophenyl)-2-[(2-methoxyphenyl)methyl]-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-6-methyl-2-o-anisyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C21H17BrN2O2S MolecularWeight: 441.34088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)CC3=CC=CC=C3OC)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)CC3=CC=CC=C3OC)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H17BrN2O2S/c1-12-18(13-7-9-15(22)10-8-13)19-20(25)23-17(24-21(19)27-12)11-14-5-3-4-6-16(14)26-2/h3-10H,11H2,1-2H3,(H,23,24,25)