3-(1-benzofuran-2-ylcarbonyl)-2-(4-butoxy-3-methoxy-phenyl)-1-(6-chloranyl-1,3-benzothiazol-2-yl)-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: 3-(1-benzofuran-2-ylcarbonyl)-2-(4-butoxy-3-methoxy-phenyl)-1-(6-chloranyl-1,3-benzothiazol-2-yl)-4-oxidanyl-2H-pyrrol-5-one Openeye Name: 3-(benzofuran-2-carbonyl)-2-(4-butoxy-3-methoxy-phenyl)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-hydroxy-2H-pyrrol-5-one CAS Name: 3-[2-benzofuranyl(oxo)methyl]-2-(4-butoxy-3-methoxyphenyl)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-hydroxy-2H-pyrrol-5-one IUPAC Name: 3-(1-benzofuran-2-carbonyl)-2-(4-butoxy-3-methoxyphenyl)-1-(6-chloro-1,3-benzothiazol-2-yl)-4-hydroxy-2H-pyrrol-5-one Traditional Name: 4-(benzofuran-2-carbonyl)-5-(4-butoxy-3-methoxy-phenyl)-1-(6-chloro-1,3-benzothiazol-2-yl)-3-hydroxy-3-pyrrolin-2-one Formula: C31H25ClN2O6S MolecularWeight: 589.058

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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=CC6=CC=CC=C6O5)OC

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=CC6=CC=CC=C6O5)OC

InChI

InChI=1S/C31H25ClN2O6S/c1-3-4-13-39-22-12-9-18(15-23(22)38-2)27-26(28(35)24-14-17-7-5-6-8-21(17)40-24)29(36)30(37)34(27)31-33-20-11-10-19(32)16-25(20)41-31/h5-12,14-16,27,36H,3-4,13H2,1-2H3