3-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 3-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-[2-(4-methoxyphenyl)ethyl]-2-(4-nitrophenyl)thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C26H19N3O5S MolecularWeight: 485.51116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCN2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4S3)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCN2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4S3)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H19N3O5S/c1-34-19-12-6-16(7-13-19)14-15-28-24(17-8-10-18(11-9-17)29(32)33)27-25-22(26(28)31)23(30)20-4-2-3-5-21(20)35-25/h2-13H,14-15H2,1H3