7-bromanyl-3-phenethyl-2-thiophen-2-yl-chromeno[2,3-d]pyrimidine-4,5-dione

Systemtic Name: 7-bromanyl-3-phenethyl-2-thiophen-2-yl-chromeno[2,3-d]pyrimidine-4,5-dione Openeye Name: 7-bromo-3-phenethyl-2-(2-thienyl)chromeno[2,3-d]pyrimidine-4,5-dione CAS Name: 7-bromo-3-phenethyl-2-thiophen-2-yl[1]benzopyrano[2,3-d]pyrimidine-4,5-dione IUPAC Name: 7-bromo-3-phenethyl-2-thiophen-2-ylchromeno[2,3-d]pyrimidine-4,5-dione Traditional Name: 7-bromo-3-phenethyl-2-(2-thienyl)chromeno[2,3-d]pyrimidine-4,5-quinone Formula: C23H15BrN2O3S MolecularWeight: 479.3458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NC3=C(C2=O)C(=O)C4=C(O3)C=CC(=C4)Br)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NC3=C(C2=O)C(=O)C4=C(O3)C=CC(=C4)Br)C5=CC=CS5

InChI

InChI=1S/C23H15BrN2O3S/c24-15-8-9-17-16(13-15)20(27)19-22(29-17)25-21(18-7-4-12-30-18)26(23(19)28)11-10-14-5-2-1-3-6-14/h1-9,12-13H,10-11H2