1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[3-(3-methylbutoxy)phenyl]-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-2-[3-(3-methylbutoxy)phenyl]-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-2-(3-isopentyloxyphenyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-2-[3-(3-methylbutoxy)phenyl]-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-5-one IUPAC Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-hydroxy-2-[3-(3-methylbutoxy)phenyl]-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-hydroxy-5-(3-isoamoxyphenyl)-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C29H28N2O4S2 MolecularWeight: 532.67362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C3=O)O)C(=O)C4=CC=CS4)C5=CC(=CC=C5)OCCC(C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3C(C(=C(C3=O)O)C(=O)C4=CC=CS4)C5=CC(=CC=C5)OCCC(C)C)C

InChI

InChI=1S/C29H28N2O4S2/c1-16(2)10-11-35-20-8-5-7-19(15-20)25-23(26(32)21-9-6-12-36-21)27(33)28(34)31(25)29-30-24-18(4)13-17(3)14-22(24)37-29/h5-9,12-16,25,33H,10-11H2,1-4H3