2-(4-butoxy-3-ethoxy-phenyl)-1-(6-chloranyl-1,3-benzothiazol-2-yl)-3-(5-methylfuran-2-yl)carbonyl-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: 2-(4-butoxy-3-ethoxy-phenyl)-1-(6-chloranyl-1,3-benzothiazol-2-yl)-3-(5-methylfuran-2-yl)carbonyl-4-oxidanyl-2H-pyrrol-5-one Openeye Name: 2-(4-butoxy-3-ethoxy-phenyl)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-2H-pyrrol-5-one CAS Name: 2-(4-butoxy-3-ethoxyphenyl)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-hydroxy-3-[(5-methyl-2-furanyl)-oxomethyl]-2H-pyrrol-5-one IUPAC Name: 2-(4-butoxy-3-ethoxyphenyl)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 5-(4-butoxy-3-ethoxy-phenyl)-1-(6-chloro-1,3-benzothiazol-2-yl)-3-hydroxy-4-(5-methyl-2-furoyl)-3-pyrrolin-2-one Formula: C29H27ClN2O6S MolecularWeight: 567.05248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)Cl)O)C(=O)C5=CC=C(O5)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)Cl)O)C(=O)C5=CC=C(O5)C)OCC

InChI

InChI=1S/C29H27ClN2O6S/c1-4-6-13-37-20-12-8-17(14-22(20)36-5-2)25-24(26(33)21-11-7-16(3)38-21)27(34)28(35)32(25)29-31-19-10-9-18(30)15-23(19)39-29/h7-12,14-15,25,34H,4-6,13H2,1-3H3