3-cycloheptyl-8-methoxy-2-thiophen-2-yl-chromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 3-cycloheptyl-8-methoxy-2-thiophen-2-yl-chromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 3-cycloheptyl-8-methoxy-2-(2-thienyl)chromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 3-cycloheptyl-8-methoxy-2-thiophen-2-yl[1]benzopyrano[2,3-d]pyrimidine-4,5-dione IUPAC Name: 3-cycloheptyl-8-methoxy-2-thiophen-2-ylchromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 3-cycloheptyl-8-methoxy-2-(2-thienyl)chromeno[2,3-d]pyrimidine-4,5-quinone Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)C3=C(O2)N=C(N(C3=O)C4CCCCCC4)C5=CC=CS5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)C3=C(O2)N=C(N(C3=O)C4CCCCCC4)C5=CC=CS5

InChI

InChI=1S/C23H22N2O4S/c1-28-15-10-11-16-17(13-15)29-22-19(20(16)26)23(27)25(14-7-4-2-3-5-8-14)21(24-22)18-9-6-12-30-18/h6,9-14H,2-5,7-8H2,1H3