3-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazolidin-3-yl]carbonyl]-4-methyl-chromen-2-one

Systemtic Name: 3-[[2-(5-bromanyl-2-methoxy-phenyl)-1,3-thiazolidin-3-yl]carbonyl]-4-methyl-chromen-2-one Openeye Name: 3-[2-(5-bromo-2-methoxy-phenyl)thiazolidine-3-carbonyl]-4-methyl-chromen-2-one CAS Name: 3-[[2-(5-bromo-2-methoxyphenyl)-3-thiazolidinyl]-oxomethyl]-4-methyl-1-benzopyran-2-one IUPAC Name: 3-[2-(5-bromo-2-methoxyphenyl)-1,3-thiazolidine-3-carbonyl]-4-methylchromen-2-one Traditional Name: 3-[2-(5-bromo-2-methoxy-phenyl)thiazolidine-3-carbonyl]-4-methyl-coumarin Formula: C21H18BrNO4S MolecularWeight: 460.34092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC=CC=C12)C(=O)N3CCSC3C4=C(C=CC(=C4)Br)OC

Isomeric SMILES

CC1=C(C(=O)OC2=CC=CC=C12)C(=O)N3CCSC3C4=C(C=CC(=C4)Br)OC

InChI

InChI=1S/C21H18BrNO4S/c1-12-14-5-3-4-6-17(14)27-21(25)18(12)19(24)23-9-10-28-20(23)15-11-13(22)7-8-16(15)26-2/h3-8,11,20H,9-10H2,1-2H3