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

Systemtic Name: 2-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methylsulfanyl]-3-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-(5-bromo-2-methoxyphenyl)-4-thiazolyl]methylthio]-3-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[[2-(5-bromo-2-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-3-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-(5-bromo-2-methoxy-phenyl)thiazol-4-yl]methylthio]-3-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C18H14BrN3O2S3 MolecularWeight: 480.42166

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=CSC(=N3)C4=C(C=CC(=C4)Br)OC)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=CSC(=N3)C4=C(C=CC(=C4)Br)OC)SC=C2

InChI

InChI=1S/C18H14BrN3O2S3/c1-22-17(23)12-5-6-25-15(12)21-18(22)27-9-11-8-26-16(20-11)13-7-10(19)3-4-14(13)24-2/h3-8H,9H2,1-2H3