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

Systemtic Name: 2-[5-azanyl-6-(4-methylphenyl)carbonyl-4-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-1-(4-methylphenyl)ethanone Openeye Name: 2-[5-amino-6-(4-methylbenzoyl)-4-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-1-(p-tolyl)ethanone CAS Name: 2-[[5-amino-6-[(4-methylphenyl)-oxomethyl]-4-phenyl-2-thieno[2,3-d]pyrimidinyl]thio]-1-(4-methylphenyl)ethanone IUPAC Name: 2-[5-amino-6-(4-methylbenzoyl)-4-phenylthieno[2,3-d]pyrimidin-2-yl]sulfanyl-1-(4-methylphenyl)ethanone Traditional Name: 2-[(5-amino-4-phenyl-6-p-toluoyl-thieno[2,3-d]pyrimidin-2-yl)thio]-1-(p-tolyl)ethanone Formula: C29H23N3O2S2 MolecularWeight: 509.64182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CSC2=NC(=C3C(=C(SC3=N2)C(=O)C4=CC=C(C=C4)C)N)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CSC2=NC(=C3C(=C(SC3=N2)C(=O)C4=CC=C(C=C4)C)N)C5=CC=CC=C5

InChI

InChI=1S/C29H23N3O2S2/c1-17-8-12-19(13-9-17)22(33)16-35-29-31-25(20-6-4-3-5-7-20)23-24(30)27(36-28(23)32-29)26(34)21-14-10-18(2)11-15-21/h3-15H,16,30H2,1-2H3