1-(4-bromophenyl)-2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-ethanone Openeye Name: 1-(4-bromophenyl)-2-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-ethanone CAS Name: 1-(4-bromophenyl)-2-[[5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]thio]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanone Traditional Name: 1-(4-bromophenyl)-2-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]thio]ethanone Formula: C21H15BrN2OS2 MolecularWeight: 455.3906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H15BrN2OS2/c1-13-2-4-14(5-3-13)17-10-26-20-19(17)21(24-12-23-20)27-11-18(25)15-6-8-16(22)9-7-15/h2-10,12H,11H2,1H3