2-(5-bromanyl-2-methoxy-phenyl)-9-ethoxy-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione

Systemtic Name: 2-(5-bromanyl-2-methoxy-phenyl)-9-ethoxy-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione Openeye Name: 2-(5-bromo-2-methoxy-phenyl)-9-ethoxy-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione CAS Name: 2-(5-bromo-2-methoxyphenyl)-9-ethoxy-1,5-dihydro[1]benzopyrano[2,3-d]pyrimidine-4-thione IUPAC Name: 2-(5-bromo-2-methoxyphenyl)-9-ethoxy-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione Traditional Name: 2-(5-bromo-2-methoxy-phenyl)-9-ethoxy-1,5-dihydrochromeno[2,3-d]pyrimidine-4-thione Formula: C20H17BrN2O3S MolecularWeight: 445.32958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC3=C(C2)C(=S)N=C(N3)C4=C(C=CC(=C4)Br)OC

Isomeric SMILES

CCOC1=CC=CC2=C1OC3=C(C2)C(=S)N=C(N3)C4=C(C=CC(=C4)Br)OC

InChI

InChI=1S/C20H17BrN2O3S/c1-3-25-16-6-4-5-11-9-14-19(26-17(11)16)22-18(23-20(14)27)13-10-12(21)7-8-15(13)24-2/h4-8,10H,3,9H2,1-2H3,(H,22,23,27)