4-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]thieno[2,3-d]pyrimidine

Systemtic Name: 4-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]thieno[2,3-d]pyrimidine Openeye Name: 4-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methylsulfanyl]thieno[2,3-d]pyrimidine CAS Name: 4-[[2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methylthio]thieno[2,3-d]pyrimidine IUPAC Name: 4-[[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]thieno[2,3-d]pyrimidine Traditional Name: 4-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methylthio]thieno[2,3-d]pyrimidine Formula: C17H12BrN3OS3 MolecularWeight: 450.39568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CSC3=NC=NC4=C3C=CS4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2=NC(=CS2)CSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C17H12BrN3OS3/c1-22-14-3-2-10(18)6-13(14)17-21-11(8-25-17)7-24-16-12-4-5-23-15(12)19-9-20-16/h2-6,8-9H,7H2,1H3