7-bromanyl-4-ethylsulfanyl-2-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine

Systemtic Name: 7-bromanyl-4-ethylsulfanyl-2-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine Openeye Name: 7-bromo-4-ethylsulfanyl-2-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine CAS Name: 7-bromo-4-(ethylthio)-2-(4-methoxyphenyl)-5H-[1]benzopyrano[2,3-d]pyrimidine IUPAC Name: 7-bromo-4-ethylsulfanyl-2-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine Traditional Name: 7-bromo-4-(ethylthio)-2-(4-methoxyphenyl)-5H-chromeno[2,3-d]pyrimidine Formula: C20H17BrN2O2S MolecularWeight: 429.33018

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=NC2=C1CC3=C(O2)C=CC(=C3)Br)C4=CC=C(C=C4)OC

Isomeric SMILES

CCSC1=NC(=NC2=C1CC3=C(O2)C=CC(=C3)Br)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H17BrN2O2S/c1-3-26-20-16-11-13-10-14(21)6-9-17(13)25-19(16)22-18(23-20)12-4-7-15(24-2)8-5-12/h4-10H,3,11H2,1-2H3