3-cycloheptyl-2-propyl-thiochromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 3-cycloheptyl-2-propyl-thiochromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-cycloheptyl-2-propyl-thiochromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-cycloheptyl-2-propylthiochromeno[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-cycloheptyl-2-propylthiochromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-cycloheptyl-2-propyl-thiochromeno[2,3-d]pyrimidine-4,5-quinone Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C(=O)C3=CC=CC=C3S2)C(=O)N1C4CCCCCC4

Isomeric SMILES

CCCC1=NC2=C(C(=O)C3=CC=CC=C3S2)C(=O)N1C4CCCCCC4

InChI

InChI=1S/C21H24N2O2S/c1-2-9-17-22-20-18(19(24)15-12-7-8-13-16(15)26-20)21(25)23(17)14-10-5-3-4-6-11-14/h7-8,12-14H,2-6,9-11H2,1H3