5-azanyl-6-(4-chlorophenyl)carbonyl-1-(4-ethanoylphenyl)thieno[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 5-azanyl-6-(4-chlorophenyl)carbonyl-1-(4-ethanoylphenyl)thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 1-(4-acetylphenyl)-5-amino-6-(4-chlorobenzoyl)thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 1-(4-acetylphenyl)-5-amino-6-[(4-chlorophenyl)-oxomethyl]thieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 1-(4-acetylphenyl)-5-amino-6-(4-chlorobenzoyl)thieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 1-(4-acetylphenyl)-5-amino-6-(4-chlorobenzoyl)thieno[2,3-d]pyrimidine-2,4-quinone Formula: C21H14ClN3O4S MolecularWeight: 439.87156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C3=C(C(=C(S3)C(=O)C4=CC=C(C=C4)Cl)N)C(=O)NC2=O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C3=C(C(=C(S3)C(=O)C4=CC=C(C=C4)Cl)N)C(=O)NC2=O

InChI

InChI=1S/C21H14ClN3O4S/c1-10(26)11-4-8-14(9-5-11)25-20-15(19(28)24-21(25)29)16(23)18(30-20)17(27)12-2-6-13(22)7-3-12/h2-9H,23H2,1H3,(H,24,28,29)