2-[5-azanyl-6-(4-bromophenyl)carbonyl-4-methylsulfanyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-1-(4-bromophenyl)ethanone

Systemtic Name: 2-[5-azanyl-6-(4-bromophenyl)carbonyl-4-methylsulfanyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-1-(4-bromophenyl)ethanone Openeye Name: 2-[5-amino-6-(4-bromobenzoyl)-4-methylsulfanyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-1-(4-bromophenyl)ethanone CAS Name: 2-[[5-amino-6-[(4-bromophenyl)-oxomethyl]-4-(methylthio)-2-thieno[2,3-d]pyrimidinyl]thio]-1-(4-bromophenyl)ethanone IUPAC Name: 2-[5-amino-6-(4-bromobenzoyl)-4-methylsulfanylthieno[2,3-d]pyrimidin-2-yl]sulfanyl-1-(4-bromophenyl)ethanone Traditional Name: 2-[[5-amino-6-(4-bromobenzoyl)-4-(methylthio)thieno[2,3-d]pyrimidin-2-yl]thio]-1-(4-bromophenyl)ethanone Formula: C22H15Br2N3O2S3 MolecularWeight: 609.3764

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC2=C1C(=C(S2)C(=O)C3=CC=C(C=C3)Br)N)SCC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CSC1=NC(=NC2=C1C(=C(S2)C(=O)C3=CC=C(C=C3)Br)N)SCC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H15Br2N3O2S3/c1-30-20-16-17(25)19(18(29)12-4-8-14(24)9-5-12)32-21(16)27-22(26-20)31-10-15(28)11-2-6-13(23)7-3-11/h2-9H,10,25H2,1H3