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

Systemtic Name: 3-[(4-nitrophenyl)methyl]-5-phenyl-1-propyl-thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 3-[(4-nitrophenyl)methyl]-5-phenyl-1-propyl-thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 3-[(4-nitrophenyl)methyl]-5-phenyl-1-propylthieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 3-[(4-nitrophenyl)methyl]-5-phenyl-1-propylthieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 3-(4-nitrobenzyl)-5-phenyl-1-propyl-thieno[2,3-d]pyrimidine-2,4-quinone Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=CS2)C3=CC=CC=C3)C(=O)N(C1=O)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN1C2=C(C(=CS2)C3=CC=CC=C3)C(=O)N(C1=O)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O4S/c1-2-12-23-21-19(18(14-30-21)16-6-4-3-5-7-16)20(26)24(22(23)27)13-15-8-10-17(11-9-15)25(28)29/h3-11,14H,2,12-13H2,1H3