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

Systemtic Name: 1-(2-methylprop-2-enyl)-3-[(4-nitrophenyl)methyl]-5-phenyl-thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 1-(2-methylallyl)-3-[(4-nitrophenyl)methyl]-5-phenyl-thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 1-(2-methylprop-2-enyl)-3-[(4-nitrophenyl)methyl]-5-phenylthieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 1-(2-methylprop-2-enyl)-3-[(4-nitrophenyl)methyl]-5-phenylthieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 1-(2-methylallyl)-3-(4-nitrobenzyl)-5-phenyl-thieno[2,3-d]pyrimidine-2,4-quinone Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1C2=C(C(=CS2)C3=CC=CC=C3)C(=O)N(C1=O)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(=C)CN1C2=C(C(=CS2)C3=CC=CC=C3)C(=O)N(C1=O)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H19N3O4S/c1-15(2)12-25-22-20(19(14-31-22)17-6-4-3-5-7-17)21(27)24(23(25)28)13-16-8-10-18(11-9-16)26(29)30/h3-11,14H,1,12-13H2,2H3