2-(4-butoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: 2-(4-butoxyphenyl)-1-(6-methyl-1,3-benzothiazol-2-yl)-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 2-(4-butoxyphenyl)-4-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 2-(4-butoxyphenyl)-4-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-5-one IUPAC Name: 2-(4-butoxyphenyl)-4-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 5-(4-butoxyphenyl)-3-hydroxy-1-(6-methyl-1,3-benzothiazol-2-yl)-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C27H24N2O4S2 MolecularWeight: 504.62046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)C)O)C(=O)C5=CC=CS5

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NC4=C(S3)C=C(C=C4)C)O)C(=O)C5=CC=CS5

InChI

InChI=1S/C27H24N2O4S2/c1-3-4-13-33-18-10-8-17(9-11-18)23-22(24(30)20-6-5-14-34-20)25(31)26(32)29(23)27-28-19-12-7-16(2)15-21(19)35-27/h5-12,14-15,23,31H,3-4,13H2,1-2H3