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

Systemtic Name: 3-cyclohexyl-2-(4-nitrophenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-cyclohexyl-2-(4-nitrophenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-cyclohexyl-2-(4-nitrophenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-cyclohexyl-2-(4-nitrophenyl)thiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-cyclohexyl-2-(4-nitrophenyl)thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C23H19N3O4S MolecularWeight: 433.47966

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4S3)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2C(=NC3=C(C2=O)C(=O)C4=CC=CC=C4S3)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H19N3O4S/c27-20-17-8-4-5-9-18(17)31-22-19(20)23(28)25(15-6-2-1-3-7-15)21(24-22)14-10-12-16(13-11-14)26(29)30/h4-5,8-13,15H,1-3,6-7H2