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

Systemtic Name: 5-(4-bromophenyl)-6-methyl-3-(3-phenylpropyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-6-methyl-3-(3-phenylpropyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-6-methyl-3-(3-phenylpropyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-bromophenyl)-6-methyl-3-(3-phenylpropyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-6-methyl-3-(3-phenylpropyl)thieno[2,3-d]pyrimidin-4-one Formula: C22H19BrN2OS MolecularWeight: 439.36806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)CCCC3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)CCCC3=CC=CC=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H19BrN2OS/c1-15-19(17-9-11-18(23)12-10-17)20-21(27-15)24-14-25(22(20)26)13-5-8-16-6-3-2-4-7-16/h2-4,6-7,9-12,14H,5,8,13H2,1H3