3-[(4-nitrophenyl)methyl]-5-phenyl-1H-thieno[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 3-[(4-nitrophenyl)methyl]-5-phenyl-1H-thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 3-[(4-nitrophenyl)methyl]-5-phenyl-1H-thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 3-[(4-nitrophenyl)methyl]-5-phenyl-1H-thieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 3-[(4-nitrophenyl)methyl]-5-phenyl-1H-thieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 3-(4-nitrobenzyl)-5-phenyl-1H-thieno[2,3-d]pyrimidine-2,4-quinone Formula: C19H13N3O4S MolecularWeight: 379.38922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=O)N3)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=O)N3)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O4S/c23-18-16-15(13-4-2-1-3-5-13)11-27-17(16)20-19(24)21(18)10-12-6-8-14(9-7-12)22(25)26/h1-9,11H,10H2,(H,20,24)